ChemicalBook > Product Catalog >Pharmaceutical intermediates >Bulk Drug Intermediates >4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid

4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid

CAS No.: 641569-94-0

Chemical Name:: 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid

Synonyms: -3-((4-(pyridin-3-yL;Nilotinib Intemediate 2;Nilotinib EP Impurity D;Nilotinib EP Impurity D/B;4-Methyl-3-((4-(pyridin-3-yl);Nilotinib Carboxylic Acid Impurity;Nilotinib Impurity 6 (Nilotinib EP Impurity D);Nilotinib Hydrochloride Monohydrate EP Impurity D;4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzoicaci;4-Methyl-3-[[4-(3-pyridinyl)-2-pyriMidiny]aMino]benzoic acid

CBNumber:: CB61503982

Molecular Formula:: C17H14N4O2

Molecular Weight:: 306.32

MOL File:: 641569-94-0.mol

MSDS File:: SDS

Modify Date:: 2024/4/28 19:50:54

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4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid Properties

Melting point	>257oC (dec.)
Boiling point	587.9±60.0 °C(Predicted)
Density	1.336
storage temp.	under inert gas (nitrogen or Argon) at 2–8 °C
solubility	DMSO (Slightly), Methanol (Slightly, Heated)
pka	4.35±0.10(Predicted)
form	Solid
color	Pale Beige
Stability	Hygroscopic
InChI	InChI=1S/C17H14N4O2/c1-11-4-5-12(16(22)23)9-15(11)21-17-19-8-6-14(20-17)13-3-2-7-18-10-13/h2-10H,1H3,(H,22,23)(H,19,20,21)
InChIKey	LDLZPHLSVKGFSC-UHFFFAOYSA-N
SMILES	C(O)(=O)C1=CC=C(C)C(NC2=NC=CC(C3=CC=CN=C3)=N2)=C1
CAS DataBase Reference	641569-94-0(CAS DataBase Reference)

SAFETY

Risk and Safety Statements

Symbol(GHS)	GHS07
Signal word	Warning
Hazard statements	H302+H312+H332-H315-H319-H335
Precautionary statements	P261-P271-P280
HS Code	2933599590

4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid Chemical Properties,Uses,Production

Uses

4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid is used in the preparation of (pyridinyl)-N-[(triazolyl)phenyl]pyrimidinamine derivatives and (pyridinyl)-N-[oxadiazolyl)phenyl]pyrimidinamine derivatives, and can be used in the detection of their activity as antileukemia agents (neoplastic stem cell leukemia). 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid is also a Nilotinib (N465300) intermediate, which might be useful in treatment of chronic myelogenous leukemia.

Synthesis

3- [(Aminoiminomethyl)amino] -4-methyl-benzoic acid methyl ester mononitrate (10 g),3-(Dimethylamino)-1-(pyridine-3-yl)prop-2-en-1-one (7.3 g), sodium hydroxide (1.7 g) was added to 1-butanol (100 mL) in a round bottom flask under nitrogen atmosphere. The reaction mass was heated to reflux temperature and stirred for 12 hours. Then the reaction mass was cooled to 25-35°C, and iN sodium hydroxide solution (1.5 g in 37 mL of DM water) was added to it throughout 20 mm. The reaction mass was heated to reflux temperature (120-125°C) and then cooled to 25-35°C. Hydrochloric acid was added to the reaction mass at 25-35°C and stirred for an hour. The material formed was filtered, washed with DM water and then dried under vacuum at 50-55°C to provide 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid (8.7 g).

4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid Preparation Products And Raw materials

Raw materials

3-[(Aminoiminomethyl)amino]-4-methylbenzoic acid ethyl ester Methyl 3-guanidino-4-Methylbenzoate Imatinib Impurity Methyl 3-amino-4-methylbenzoate 3-Amino-4-methylbenzoic acid

3-[(aMinoiMinoMethyl)aMino]-4-Methylbenzoic acid Methyl ester Mononitrate 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid methyl ester 3-[(Aminoiminomethyl)amino]-4-methylbenzoic acid ethyl ester mononitrate Ethyl 3-Amino-4-methylbenzoate 3-Acetylpyridine

3-Bromo-4-methylbenzoic acid

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Preparation Products

Nilotinib

4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid Suppliers

Global( 256)Suppliers

Supplier	Tel	Country	ProdList	Advantage	Inquiry
Urantiis Pharmaceuticals Private Limited	+918790703567	AndhraPradesh, India	80	58	Inquiry
Rampex Labs Private Limited	+91 9168074433	Telangana, India	71	58	Inquiry
Litha Life Sciences Pvt Limited	+91-9849999500 +91-9849999500	Hyderabad, India	29	58	Inquiry
Credas Labs Pvt Ltd	+91 9133918031	Hyderabad, India	119	58	Inquiry
TRC FINE CHEMS	+91-7400278327 +91-8097105248	Mumbai, India	73	58	Inquiry
Lorven therapeutics Pvt Ltd	+91-8884110005 +91-8884110005	Hyderabad, India	110	58	Inquiry
VGS SYNTHESIS PRIVATE LIMITED	+91-9866975588 +91-9866975588	Hyderabad, India	1818	58	Inquiry
Raising Sun Pharma	+91-9399941155 +91-9399941155	Telangana, India	127	58	Inquiry
Lakshmi Farmachem	+91-9948795885 +91-9550886476	Telangana, India	407	58	Inquiry
Accrete Pharmaceuticals Private Limited	+91-9246370012 +91-9246370012	Hyderabad, India	24	58	Inquiry

Supplier	Advantage
Urantiis Pharmaceuticals Private Limited	58
Rampex Labs Private Limited	58
Litha Life Sciences Pvt Limited	58
Credas Labs Pvt Ltd	58
TRC FINE CHEMS	58
Lorven therapeutics Pvt Ltd	58
VGS SYNTHESIS PRIVATE LIMITED	58
Raising Sun Pharma	58
Lakshmi Farmachem	58
Accrete Pharmaceuticals Private Limited	58

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4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid 4-Methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzoic acid Benzoic acid, 4-Methyl-3-[[4-(3-pyridinyl)-2-pyriMidinyl]aMino]- 4-Methyl-3-[[4-(3-pyridinyl)-2-pyriMidiny]aMino]benzoic acid 2-[(5-Carboxy-2-methylphenyl)amino]-4-(pyridin-3-yl)pyrimidine, 3-{2-[(5-Carboxy-2-methylphenyl)amino]pyrimidin-4-yl}pyridine Nilotinib Intemediate 2 4-Methyl-3-((4-(pyridin-3-yl) Nilotinib EP Impurity D Nilotinib Carboxylic Acid Impurity -3-((4-(pyridin-3-yL 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid(For export only) Nilotinib EP Impurity D/B 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic aci... 3-(4-(pyridin-3-yl)pyrimidin-2-ylamino)-4-methylbenzoic acid 4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzoicaci Nilotinib Impurity 6 (Nilotinib EP Impurity D) Nilotinib Hydrochloride Monohydrate EP Impurity D 4-Methyl-3-[[4-G-pyridinyl)-2-pyrimidinyl]amino] benzoic acid 641569-94-0 641589-94-0