AB00685216-01
TL;DR: AB00685216-01 (CAS 477494-07-8) is a chemical compound with molecular formula C17H16Cl2N2O2S and molecular weight 382.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-dichlorobenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Also Known As: AB00685216-01, 2-(3,5-dichlorobenzamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide, F0806-0366, 2-(3,5-dichlorobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide, 2-[(3,5-dichlorobenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
| Molecular Formula | C17H16Cl2N2O2S |
|---|---|
| Molecular Weight | 382.03 g/mol |
| LogP | 4.675 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.03094 |
| Heavy Atoms | 24 |
| Complexity | 796.9122 |
Chemical Identifiers
| CAS Number | 477494-07-8 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)C3=CC(=CC(=C3)Cl)Cl |
Product Overview
AB00685216-01 (CAS 477494-07-8), with molecular formula C17H16Cl2N2O2S and molecular weight 382.03 g/mol. IUPAC: 2-[(3,5-dichlorobenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide.
Chemical Property Profile of AB00685216-01
Property Insights of AB00685216-01
The XLogP value of 4.675 indicates that AB00685216-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00685216-01. Following Lipinski's Rule of Five, AB00685216-01 has 2 hydrogen bond donor(s) and 3 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 AB00685216-01?
The CAS number of AB00685216-01 is 477494-07-8.
What is the molecular formula of AB00685216-01?
The molecular formula of AB00685216-01 is C17H16Cl2N2O2S.
What is the molecular weight of AB00685216-01?
The molecular weight of AB00685216-01 is 382.03 g/mol.
Where can I buy AB00685216-01?
You can request a quote for AB00685216-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00685216-01?
Yes, KEHONG BIO provides custom synthesis services for AB00685216-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.