2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide
TL;DR: 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide (CAS 85678-88-2) is a chemical compound with molecular formula C13H7Cl2N3OS and molecular weight 322.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide
Also Known As: N-propylpiperonylideneamine, 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide, 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)nicotinamide, 2-Chloro-N-(4-chlorobenzo[d]thiazol-2-yl)nicotinamide, AO-095/41417033
| Molecular Formula | C13H7Cl2N3OS |
|---|---|
| Molecular Weight | 322.97 g/mol |
| LogP | 4.2504 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.9687 |
| Heavy Atoms | 20 |
| Complexity | 803.1655 |
Chemical Identifiers
| CAS Number | 85678-88-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)Cl)N=C(S2)NC(=O)C3=C(N=CC=C3)Cl |
Product Overview
2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide (CAS 85678-88-2), with molecular formula C13H7Cl2N3OS and molecular weight 322.97 g/mol. IUPAC: 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide.
Chemical Property Profile of 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide
Property Insights of 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide
The XLogP value of 4.2504 indicates that 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide has 1 hydrogen bond donor(s) and 4 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 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide?
The CAS number of 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide is 85678-88-2.
What is the molecular formula of 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide?
The molecular formula of 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide is C13H7Cl2N3OS.
What is the molecular weight of 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide?
The molecular weight of 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide is 322.97 g/mol.
Where can I buy 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide?
You can request a quote for 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(4-chloro-1,3-benzothiazol-2-yl)pyridine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.