AB00672571-01
TL;DR: AB00672571-01 (CAS 477494-22-7) is a chemical compound with molecular formula C23H22N2O3S and molecular weight 406.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-phenoxybenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Also Known As: AB00672571-01, 2-(2-phenoxybenzamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide, F0806-0383, 2-(2-phenoxybenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide, 2-[(2-phenoxybenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
| Molecular Formula | C23H22N2O3S |
|---|---|
| Molecular Weight | 406.14 g/mol |
| LogP | 5.1605 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.1351 |
| Heavy Atoms | 29 |
| Complexity | 1043.5315 |
Chemical Identifiers
| CAS Number | 477494-22-7 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)C3=CC=CC=C3OC4=CC=CC=C4 |
Product Overview
AB00672571-01 (CAS 477494-22-7), with molecular formula C23H22N2O3S and molecular weight 406.14 g/mol. IUPAC: 2-[(2-phenoxybenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide.
Chemical Property Profile of AB00672571-01
Property Insights of AB00672571-01
The XLogP value of 5.1605 indicates that AB00672571-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.42 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00672571-01. Following Lipinski's Rule of Five, AB00672571-01 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00672571-01?
The CAS number of AB00672571-01 is 477494-22-7.
What is the molecular formula of AB00672571-01?
The molecular formula of AB00672571-01 is C23H22N2O3S.
What is the molecular weight of AB00672571-01?
The molecular weight of AB00672571-01 is 406.14 g/mol.
Where can I buy AB00672571-01?
You can request a quote for AB00672571-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672571-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672571-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.