BAS 01539576
TL;DR: BAS 01539576 (CAS 302950-27-2) is a chemical compound with molecular formula C19H19NO6S and molecular weight 389.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[(3-methoxybenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Also Known As: BAS 01539576, dimethyl 2-[(3-methoxybenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate, dimethyl 2-(3-methoxybenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate, 3,4-DIMETHYL 2-(3-METHOXYBENZAMIDO)-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3,4-DICARBOXYLATE, dimethyl 2-{[(3-methoxyphenyl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
| Molecular Formula | C19H19NO6S |
|---|---|
| Molecular Weight | 389.09 g/mol |
| LogP | 2.9984 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.09332 |
| Heavy Atoms | 27 |
| Complexity | 903.6 |
Chemical Identifiers
| CAS Number | 302950-27-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCC3C(=O)OC)C(=O)OC |
Product Overview
BAS 01539576 (CAS 302950-27-2), with molecular formula C19H19NO6S and molecular weight 389.09 g/mol. IUPAC: dimethyl 2-[(3-methoxybenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate.
Chemical Property Profile of BAS 01539576
Property Insights of BAS 01539576
The XLogP value of 2.9984 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01539576. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01539576. Following Lipinski's Rule of Five, BAS 01539576 has 1 hydrogen bond donor(s) and 7 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 BAS 01539576?
The CAS number of BAS 01539576 is 302950-27-2.
What is the molecular formula of BAS 01539576?
The molecular formula of BAS 01539576 is C19H19NO6S.
What is the molecular weight of BAS 01539576?
The molecular weight of BAS 01539576 is 389.09 g/mol.
Where can I buy BAS 01539576?
You can request a quote for BAS 01539576 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01539576?
Yes, KEHONG BIO provides custom synthesis services for BAS 01539576 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.