BAS 00845444
TL;DR: BAS 00845444 (CAS 5732-55-8) is a chemical compound with molecular formula C19H24N2O4S2 and molecular weight 408.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-ethoxy-N-methylsulfonylanilino)-N-(2-phenylsulfanylethyl)acetamide
Also Known As: BAS 00845444, BIM-0000743.P001, N~2~-(4-ethoxyphenyl)-N~2~-(methylsulfonyl)-N-[2-(phenylsulfanyl)ethyl]glycinamide, N~2~-(4-ethoxyphenyl)-N~2~-(methylsulfonyl)-N~1~-[2-(phenylthio)ethyl]glycinamide, 2-(4-ethoxy-N-methylsulfonylanilino)-N-(2-phenylsulfanylethyl)acetamide
| Molecular Formula | C19H24N2O4S2 |
|---|---|
| Molecular Weight | 408.12 g/mol |
| LogP | 2.7598 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 408.11774 |
| Heavy Atoms | 27 |
| Complexity | 824.548 |
Chemical Identifiers
| CAS Number | 5732-55-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N(CC(=O)NCCSC2=CC=CC=C2)S(=O)(=O)C |
Product Overview
BAS 00845444 (CAS 5732-55-8), with molecular formula C19H24N2O4S2 and molecular weight 408.12 g/mol. IUPAC: 2-(4-ethoxy-N-methylsulfonylanilino)-N-(2-phenylsulfanylethyl)acetamide.
Chemical Property Profile of BAS 00845444
Property Insights of BAS 00845444
The XLogP value of 2.7598 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00845444. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00845444. Following Lipinski's Rule of Five, BAS 00845444 has 1 hydrogen bond donor(s) and 5 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 00845444?
The CAS number of BAS 00845444 is 5732-55-8.
What is the molecular formula of BAS 00845444?
The molecular formula of BAS 00845444 is C19H24N2O4S2.
What is the molecular weight of BAS 00845444?
The molecular weight of BAS 00845444 is 408.12 g/mol.
Where can I buy BAS 00845444?
You can request a quote for BAS 00845444 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00845444?
Yes, KEHONG BIO provides custom synthesis services for BAS 00845444 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.