AB00674350-01
TL;DR: AB00674350-01 (CAS 618078-76-5) is a chemical compound with molecular formula C20H21ClN2O4S2 and molecular weight 452.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-chlorobenzoyl)amino]-N-(1,1-dioxothiolan-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: AB00674350-01, F1423-2223, 2-(2-chlorobenzamido)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide, 2-(2-chlorobenzamido)-N-(1,1-dioxo-1lambda6-thiolan-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-[(2-chlorobenzoyl)amino]-N-(1,1-dioxothiolan-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C20H21ClN2O4S2 |
|---|---|
| Molecular Weight | 452.06 g/mol |
| LogP | 3.4495 |
| Topological Polar Surface Area | 92.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 452.06314 |
| Heavy Atoms | 29 |
| Complexity | 1078.1455 |
Chemical Identifiers
| CAS Number | 618078-76-5 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3Cl)C(=O)NC4CCS(=O)(=O)C4 |
Product Overview
AB00674350-01 (CAS 618078-76-5), with molecular formula C20H21ClN2O4S2 and molecular weight 452.06 g/mol. IUPAC: 2-[(2-chlorobenzoyl)amino]-N-(1,1-dioxothiolan-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of AB00674350-01
Property Insights of AB00674350-01
The XLogP value of 3.4495 indicates that AB00674350-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.34 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00674350-01. Following Lipinski's Rule of Five, AB00674350-01 has 2 hydrogen bond donor(s) and 5 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 AB00674350-01?
The CAS number of AB00674350-01 is 618078-76-5.
What is the molecular formula of AB00674350-01?
The molecular formula of AB00674350-01 is C20H21ClN2O4S2.
What is the molecular weight of AB00674350-01?
The molecular weight of AB00674350-01 is 452.06 g/mol.
Where can I buy AB00674350-01?
You can request a quote for AB00674350-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674350-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674350-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.