ChemDiv3_001981
TL;DR: ChemDiv3_001981 (CAS 397288-60-7) is a chemical compound with molecular formula C24H20N2O5S2 and molecular weight 480.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-1-benzothiophene-2-carboxylate
Also Known As: ChemDiv3_001981, IDI1_020947, BRD-K57785343-001-01-7, F0816-0217, methyl 3-{4-[methyl(phenyl)sulfamoyl]benzamido}-1-benzothiophene-2-carboxylate
| Molecular Formula | C24H20N2O5S2 |
|---|---|
| Molecular Weight | 480.08 g/mol |
| LogP | 4.7653 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.08136 |
| Heavy Atoms | 33 |
| Complexity | 1429.0083 |
Chemical Identifiers
| CAS Number | 397288-60-7 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(SC4=CC=CC=C43)C(=O)OC |
Product Overview
ChemDiv3_001981 (CAS 397288-60-7), with molecular formula C24H20N2O5S2 and molecular weight 480.08 g/mol. IUPAC: methyl 3-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-1-benzothiophene-2-carboxylate.
Chemical Property Profile of ChemDiv3_001981
Property Insights of ChemDiv3_001981
The XLogP value of 4.7653 indicates that ChemDiv3_001981 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_001981. Following Lipinski's Rule of Five, ChemDiv3_001981 has 1 hydrogen bond donor(s) and 6 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 ChemDiv3_001981?
The CAS number of ChemDiv3_001981 is 397288-60-7.
What is the molecular formula of ChemDiv3_001981?
The molecular formula of ChemDiv3_001981 is C24H20N2O5S2.
What is the molecular weight of ChemDiv3_001981?
The molecular weight of ChemDiv3_001981 is 480.08 g/mol.
Where can I buy ChemDiv3_001981?
You can request a quote for ChemDiv3_001981 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_001981?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_001981 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.