AB00666939-01
TL;DR: AB00666939-01 (CAS 329906-06-1) is a chemical compound with molecular formula C23H23N3O4S2 and molecular weight 469.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: AB00666939-01, F0161-0031, 2-(4-(N-methyl-N-phenylsulfamoyl)benzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide, 2-{4-[METHYL(PHENYL)SULFAMOYL]BENZAMIDO}-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE, 2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C23H23N3O4S2 |
|---|---|
| Molecular Weight | 469.11 g/mol |
| LogP | 3.8032 |
| Topological Polar Surface Area | 109.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 469.113 |
| Heavy Atoms | 32 |
| Complexity | 1266.5753 |
Chemical Identifiers
| CAS Number | 329906-06-1 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)N |
Product Overview
AB00666939-01 (CAS 329906-06-1), with molecular formula C23H23N3O4S2 and molecular weight 469.11 g/mol. IUPAC: 2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of AB00666939-01
Property Insights of AB00666939-01
The XLogP value of 3.8032 indicates that AB00666939-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.57 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00666939-01. Following Lipinski's Rule of Five, AB00666939-01 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 AB00666939-01?
The CAS number of AB00666939-01 is 329906-06-1.
What is the molecular formula of AB00666939-01?
The molecular formula of AB00666939-01 is C23H23N3O4S2.
What is the molecular weight of AB00666939-01?
The molecular weight of AB00666939-01 is 469.11 g/mol.
Where can I buy AB00666939-01?
You can request a quote for AB00666939-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00666939-01?
Yes, KEHONG BIO provides custom synthesis services for AB00666939-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.