BAS 00754449
TL;DR: BAS 00754449 (CAS 6071-45-0) is a chemical compound with molecular formula C19H24N2O3S2 and molecular weight 392.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methyl-N-methylsulfonylanilino)-N-[2-(4-methylphenyl)sulfanylethyl]acetamide
Also Known As: BAS 00754449, BIM-0012648.P001, 2-(2-methyl-N-methylsulfonylanilino)-N-[2-(4-methylphenyl)sulfanylethyl]acetamide, N~2~-(2-methylphenyl)-N~1~-{2-[(4-methylphenyl)thio]ethyl}-N~2~-(methylsulfonyl)glycinamide, 2-(Methanesulfonyl-o-tolyl-amino)-N-(2-p-tolylsulfanyl-ethyl)-acetamide
| Molecular Formula | C19H24N2O3S2 |
|---|---|
| Molecular Weight | 392.12 g/mol |
| LogP | 2.97794 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 392.12283 |
| Heavy Atoms | 26 |
| Complexity | 849.3429 |
Chemical Identifiers
| CAS Number | 6071-45-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCCNC(=O)CN(C2=CC=CC=C2C)S(=O)(=O)C |
Product Overview
BAS 00754449 (CAS 6071-45-0), with molecular formula C19H24N2O3S2 and molecular weight 392.12 g/mol. IUPAC: 2-(2-methyl-N-methylsulfonylanilino)-N-[2-(4-methylphenyl)sulfanylethyl]acetamide.
Chemical Property Profile of BAS 00754449
Property Insights of BAS 00754449
The XLogP value of 2.97794 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00754449. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00754449. Following Lipinski's Rule of Five, BAS 00754449 has 1 hydrogen bond donor(s) and 4 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 00754449?
The CAS number of BAS 00754449 is 6071-45-0.
What is the molecular formula of BAS 00754449?
The molecular formula of BAS 00754449 is C19H24N2O3S2.
What is the molecular weight of BAS 00754449?
The molecular weight of BAS 00754449 is 392.12 g/mol.
Where can I buy BAS 00754449?
You can request a quote for BAS 00754449 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00754449?
Yes, KEHONG BIO provides custom synthesis services for BAS 00754449 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.