N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide
TL;DR: N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide (CAS 642429-79-6) is a chemical compound with molecular formula C17H11ClN4OS and molecular weight 354.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-chloro-2-phenylbenzotriazol-5-yl)thiophene-2-carboxamide
Also Known As: AP-970/42166148, N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide, N-(6-chloro-2-phenylbenzotriazol-5-yl)thiophene-2-carboxamide, N-(6-chloro-2-phenyl-2H-benzotriazol-5-yl)thiophene-2-carboxamide
| Molecular Formula | C17H11ClN4OS |
|---|---|
| Molecular Weight | 354.03 g/mol |
| LogP | 4.3877 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.0342 |
| Heavy Atoms | 24 |
| Complexity | 1011.9461 |
Chemical Identifiers
| CAS Number | 642429-79-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=CC=CS4 |
Product Overview
N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide (CAS 642429-79-6), with molecular formula C17H11ClN4OS and molecular weight 354.03 g/mol. IUPAC: N-(6-chloro-2-phenylbenzotriazol-5-yl)thiophene-2-carboxamide.
Chemical Property Profile of N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide
Property Insights of N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide
The XLogP value of 4.3877 indicates that N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide 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 N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide?
The CAS number of N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide is 642429-79-6.
What is the molecular formula of N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide?
The molecular formula of N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide is C17H11ClN4OS.
What is the molecular weight of N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide?
The molecular weight of N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide is 354.03 g/mol.
Where can I buy N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide?
You can request a quote for N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-chloro-2-phenyl-2H-1,2,3-benzotriazol-5-yl)-2-thiophenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.