4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid
TL;DR: 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid (CAS 315703-23-2) is a chemical compound with molecular formula C15H11N3O2S and molecular weight 297.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]benzoic acid
Also Known As: BAS 00853848, 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid, 4-{[4-(3-pyridinyl)-1,3-thiazol-2-yl]amino}benzoic acid, 4-[[4-(3-Pyridinyl)-2-thiazolyl]amino]benzoic acid, 4-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]benzoic acid
| Molecular Formula | C15H11N3O2S |
|---|---|
| Molecular Weight | 297.06 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.0572 |
| Heavy Atoms | 21 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 315703-23-2 |
|---|---|
| SMILES | C1=CC(=CN=C1)C2=CSC(=N2)NC3=CC=C(C=C3)C(=O)O |
| InChIKey | VOAGRCWYJDZBFU-UHFFFAOYSA-N |
Product Overview
4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid (CAS 315703-23-2), with molecular formula C15H11N3O2S and molecular weight 297.06 g/mol. IUPAC: 4-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]benzoic acid.
Chemical Property Profile of 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid
Property Insights of 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid. Following Lipinski's Rule of Five, 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid?
The CAS number of 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid is 315703-23-2.
What is the molecular formula of 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid?
The molecular formula of 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid is C15H11N3O2S.
What is the molecular weight of 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid?
The molecular weight of 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid is 297.06 g/mol.
Where can I buy 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid?
You can request a quote for 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Pyridin-3-yl-thiazol-2-ylamino)-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.