BAS 00897430
TL;DR: BAS 00897430 (CAS 329196-01-2) is a chemical compound with molecular formula C24H23ClN2O5S2 and molecular weight 518.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(benzenesulfonamido)-4-chlorobenzoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BAS 00897430, ethyl 2-({4-chloro-2-[(phenylsulfonyl)amino]benzoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(4-chloro-2-(phenylsulfonamido)benzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-[({4-chloro-2-[(phenylsulfonyl)amino]phenyl}carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[[2-(benzenesulfonamido)-4-chlorobenzoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C24H23ClN2O5S2 |
|---|---|
| Molecular Weight | 518.07 g/mol |
| LogP | 5.5101 |
| Topological Polar Surface Area | 101.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 518.07367 |
| Heavy Atoms | 34 |
| Complexity | 1336.8932 |
Chemical Identifiers
| CAS Number | 329196-01-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(C=C(C=C3)Cl)NS(=O)(=O)C4=CC=CC=C4 |
Product Overview
BAS 00897430 (CAS 329196-01-2), with molecular formula C24H23ClN2O5S2 and molecular weight 518.07 g/mol. IUPAC: ethyl 2-[[2-(benzenesulfonamido)-4-chlorobenzoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 00897430
Property Insights of BAS 00897430
The XLogP value of 5.5101 indicates that BAS 00897430 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.57 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00897430. Following Lipinski's Rule of Five, BAS 00897430 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00897430?
The CAS number of BAS 00897430 is 329196-01-2.
What is the molecular formula of BAS 00897430?
The molecular formula of BAS 00897430 is C24H23ClN2O5S2.
What is the molecular weight of BAS 00897430?
The molecular weight of BAS 00897430 is 518.07 g/mol.
Where can I buy BAS 00897430?
You can request a quote for BAS 00897430 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00897430?
Yes, KEHONG BIO provides custom synthesis services for BAS 00897430 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.