BAS 01026572
TL;DR: BAS 01026572 (CAS 136918-55-3) is a chemical compound with molecular formula C19H17NO4S2 and molecular weight 387.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-acetamido-7-hydroxy-6-phenylsulfanyl-1-benzothiophene-3-carboxylate
Also Known As: BAS 01026572, 2-acetylamino-7-hydroxy-6-phenylthio-3-carbethoxybenzo[b]thiophene, ethyl 2-(acetylamino)-7-hydroxy-6-(phenylsulfanyl)-1-benzothiophene-3-carboxylate, ethyl 2-acetamido-7-hydroxy-6-(phenylthio)benzo[b]thiophene-3-carboxylate, ethyl 2-acetamido-7-hydroxy-6-phenylsulfanyl-1-benzothiophene-3-carboxylate
| Molecular Formula | C19H17NO4S2 |
|---|---|
| Molecular Weight | 387.06 g/mol |
| LogP | 4.8932 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.0599 |
| Heavy Atoms | 26 |
| Complexity | 966.5796 |
Chemical Identifiers
| CAS Number | 136918-55-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1C=CC(=C2O)SC3=CC=CC=C3)NC(=O)C |
Product Overview
BAS 01026572 (CAS 136918-55-3), with molecular formula C19H17NO4S2 and molecular weight 387.06 g/mol. IUPAC: ethyl 2-acetamido-7-hydroxy-6-phenylsulfanyl-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 01026572
Property Insights of BAS 01026572
The XLogP value of 4.8932 indicates that BAS 01026572 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01026572. Following Lipinski's Rule of Five, BAS 01026572 has 2 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 BAS 01026572?
The CAS number of BAS 01026572 is 136918-55-3.
What is the molecular formula of BAS 01026572?
The molecular formula of BAS 01026572 is C19H17NO4S2.
What is the molecular weight of BAS 01026572?
The molecular weight of BAS 01026572 is 387.06 g/mol.
Where can I buy BAS 01026572?
You can request a quote for BAS 01026572 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01026572?
Yes, KEHONG BIO provides custom synthesis services for BAS 01026572 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.