AB00672577-01
TL;DR: AB00672577-01 (CAS 352689-48-6) is a chemical compound with molecular formula C18H19ClN2O3S and molecular weight 378.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(4-chlorophenoxy)acetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Also Known As: AB00672577-01, 2-[2-(4-chlorophenoxy)acetamido]-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide, 2-{[(4-chlorophenoxy)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide, F0806-0401, 2-(2-(4-chlorophenoxy)acetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
| Molecular Formula | C18H19ClN2O3S |
|---|---|
| Molecular Weight | 378.08 g/mol |
| LogP | 3.7868 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.0805 |
| Heavy Atoms | 25 |
| Complexity | 786.364 |
Chemical Identifiers
| CAS Number | 352689-48-6 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)COC3=CC=C(C=C3)Cl |
Product Overview
AB00672577-01 (CAS 352689-48-6), with molecular formula C18H19ClN2O3S and molecular weight 378.08 g/mol. IUPAC: 2-[[2-(4-chlorophenoxy)acetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide.
Chemical Property Profile of AB00672577-01
Property Insights of AB00672577-01
The XLogP value of 3.7868 indicates that AB00672577-01 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 AB00672577-01. Following Lipinski's Rule of Five, AB00672577-01 has 2 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 AB00672577-01?
The CAS number of AB00672577-01 is 352689-48-6.
What is the molecular formula of AB00672577-01?
The molecular formula of AB00672577-01 is C18H19ClN2O3S.
What is the molecular weight of AB00672577-01?
The molecular weight of AB00672577-01 is 378.08 g/mol.
Where can I buy AB00672577-01?
You can request a quote for AB00672577-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672577-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672577-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.