BAS 10187959
TL;DR: BAS 10187959 (CAS 833435-87-3) is a chemical compound with molecular formula C17H18N2O5S2 and molecular weight 394.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-methylsulfanylphenyl)acetamide
Also Known As: BAS 10187959, 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-methylsulfanylphenyl)acetamide, N~2~-1,3-benzodioxol-5-yl-N-[3-(methylsulfanyl)phenyl]-N~2~-(methylsulfonyl)glycinamide
| Molecular Formula | C17H18N2O5S2 |
|---|---|
| Molecular Weight | 394.07 g/mol |
| LogP | 2.5419 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.0657 |
| Heavy Atoms | 26 |
| Complexity | 930.50055 |
Chemical Identifiers
| CAS Number | 833435-87-3 |
|---|---|
| SMILES | CSC1=CC=CC(=C1)NC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C |
Product Overview
BAS 10187959 (CAS 833435-87-3), with molecular formula C17H18N2O5S2 and molecular weight 394.07 g/mol. IUPAC: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-methylsulfanylphenyl)acetamide.
Chemical Property Profile of BAS 10187959
Property Insights of BAS 10187959
The XLogP value of 2.5419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 10187959. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10187959. Following Lipinski's Rule of Five, BAS 10187959 has 1 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 10187959?
The CAS number of BAS 10187959 is 833435-87-3.
What is the molecular formula of BAS 10187959?
The molecular formula of BAS 10187959 is C17H18N2O5S2.
What is the molecular weight of BAS 10187959?
The molecular weight of BAS 10187959 is 394.07 g/mol.
Where can I buy BAS 10187959?
You can request a quote for BAS 10187959 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10187959?
Yes, KEHONG BIO provides custom synthesis services for BAS 10187959 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.