BAS 01248735
TL;DR: BAS 01248735 (CAS 332162-39-7) is a chemical compound with molecular formula C26H31ClN2O4S and molecular weight 502.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[(3-chlorobenzoyl)-cyclohexylamino]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BAS 01248735, Ethyl 2-(2-(3-chloro-N-cyclohexylbenzamido)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-[[2-[(3-chlorobenzoyl)-cyclohexylamino]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, 2-{2-[(3-Chloro-benzoyl)-cyclohexyl-amino]-acetylamino}-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid ethyl ester, ethyl 2-({[(3-chlorobenzoyl)(cyclohexyl)amino]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C26H31ClN2O4S |
|---|---|
| Molecular Weight | 502.17 g/mol |
| LogP | 5.8706 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 502.1693 |
| Heavy Atoms | 34 |
| Complexity | 1061.0652 |
Chemical Identifiers
| CAS Number | 332162-39-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN(C3CCCCC3)C(=O)C4=CC(=CC=C4)Cl |
Product Overview
BAS 01248735 (CAS 332162-39-7), with molecular formula C26H31ClN2O4S and molecular weight 502.17 g/mol. IUPAC: ethyl 2-[[2-[(3-chlorobenzoyl)-cyclohexylamino]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 01248735
Property Insights of BAS 01248735
The XLogP value of 5.8706 indicates that BAS 01248735 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01248735. Following Lipinski's Rule of Five, BAS 01248735 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01248735?
The CAS number of BAS 01248735 is 332162-39-7.
What is the molecular formula of BAS 01248735?
The molecular formula of BAS 01248735 is C26H31ClN2O4S.
What is the molecular weight of BAS 01248735?
The molecular weight of BAS 01248735 is 502.17 g/mol.
Where can I buy BAS 01248735?
You can request a quote for BAS 01248735 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01248735?
Yes, KEHONG BIO provides custom synthesis services for BAS 01248735 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.