A1931/0081273
TL;DR: A1931/0081273 (CAS 312917-35-4) is a chemical compound with molecular formula C20H23NO5S and molecular weight 389.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3,5-dimethoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: A1931/0081273, ETHYL 2-(3,5-DIMETHOXYBENZAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, ethyl 2-(3,5-dimethoxybenzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-[(3,5-dimethoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-{[(3,5-dimethoxyphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C20H23NO5S |
|---|---|
| Molecular Weight | 389.13 g/mol |
| LogP | 4.0731 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 389.1297 |
| Heavy Atoms | 27 |
| Complexity | 836.04724 |
Chemical Identifiers
| CAS Number | 312917-35-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=CC(=C3)OC)OC |
Product Overview
A1931/0081273 (CAS 312917-35-4), with molecular formula C20H23NO5S and molecular weight 389.13 g/mol. IUPAC: ethyl 2-[(3,5-dimethoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of A1931/0081273
Property Insights of A1931/0081273
The XLogP value of 4.0731 indicates that A1931/0081273 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for A1931/0081273. Following Lipinski's Rule of Five, A1931/0081273 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 A1931/0081273?
The CAS number of A1931/0081273 is 312917-35-4.
What is the molecular formula of A1931/0081273?
The molecular formula of A1931/0081273 is C20H23NO5S.
What is the molecular weight of A1931/0081273?
The molecular weight of A1931/0081273 is 389.13 g/mol.
Where can I buy A1931/0081273?
You can request a quote for A1931/0081273 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1931/0081273?
Yes, KEHONG BIO provides custom synthesis services for A1931/0081273 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.