BAS 08309162
TL;DR: BAS 08309162 (CAS 578724-29-5) is a chemical compound with molecular formula C18H21NO6S2 and molecular weight 411.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3,4-dimethoxyphenyl)sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BAS 08309162, methyl 2-(3,4-dimethoxyphenylsulfonamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, METHYL 2-(3,4-DIMETHOXYBENZENESULFONAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, methyl 2-[(3,4-dimethoxyphenyl)sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 2-{[(3,4-dimethoxyphenyl)sulfonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C18H21NO6S2 |
|---|---|
| Molecular Weight | 411.08 g/mol |
| LogP | 3.2315 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.08102 |
| Heavy Atoms | 27 |
| Complexity | 964.47174 |
Chemical Identifiers
| CAS Number | 578724-29-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC)OC |
Product Overview
BAS 08309162 (CAS 578724-29-5), with molecular formula C18H21NO6S2 and molecular weight 411.08 g/mol. IUPAC: methyl 2-[(3,4-dimethoxyphenyl)sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 08309162
Property Insights of BAS 08309162
The XLogP value of 3.2315 indicates that BAS 08309162 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08309162. Following Lipinski's Rule of Five, BAS 08309162 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 08309162?
The CAS number of BAS 08309162 is 578724-29-5.
What is the molecular formula of BAS 08309162?
The molecular formula of BAS 08309162 is C18H21NO6S2.
What is the molecular weight of BAS 08309162?
The molecular weight of BAS 08309162 is 411.08 g/mol.
Where can I buy BAS 08309162?
You can request a quote for BAS 08309162 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08309162?
Yes, KEHONG BIO provides custom synthesis services for BAS 08309162 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.