BAS 00795835
TL;DR: BAS 00795835 (CAS 325987-64-2) is a chemical compound with molecular formula C17H16ClNO3S and molecular weight 349.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-chlorobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: BAS 00795835, F0016-0692, AE-848/34328023, ethyl 2-[(3-chlorobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ETHYL 2-(3-CHLOROBENZAMIDO)-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLATE
| Molecular Formula | C17H16ClNO3S |
|---|---|
| Molecular Weight | 349.05 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.05396 |
| Heavy Atoms | 23 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 325987-64-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=CC=C3)Cl |
| InChIKey | JUWAGZALCAMHJW-UHFFFAOYSA-N |
Product Overview
BAS 00795835 (CAS 325987-64-2), with molecular formula C17H16ClNO3S and molecular weight 349.05 g/mol. IUPAC: ethyl 2-[(3-chlorobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of BAS 00795835
Property Insights of BAS 00795835
The XLogP value of 4.9 indicates that BAS 00795835 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00795835. Following Lipinski's Rule of Five, BAS 00795835 has 1 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 BAS 00795835?
The CAS number of BAS 00795835 is 325987-64-2.
What is the molecular formula of BAS 00795835?
The molecular formula of BAS 00795835 is C17H16ClNO3S.
What is the molecular weight of BAS 00795835?
The molecular weight of BAS 00795835 is 349.05 g/mol.
Where can I buy BAS 00795835?
You can request a quote for BAS 00795835 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00795835?
Yes, KEHONG BIO provides custom synthesis services for BAS 00795835 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.