BAS 04921077
TL;DR: BAS 04921077 (CAS 446056-79-7) is a chemical compound with molecular formula C21H24ClN3O5S and molecular weight 465.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-chloro-2-methoxy-N-methylsulfonylanilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
Also Known As: BAS 04921077, 2-(5-chloro-2-methoxy-N-methylsulfonylanilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide, 2-[(5-Chloro-2-methoxy-phenyl)-methanesulfonyl-amino]-N-[2-(pyrrolidine-1-carbonyl)-phenyl]-acetamide, N~2~-(5-chloro-2-methoxyphenyl)-N~2~-(methylsulfonyl)-N-[2-(pyrrolidin-1-ylcarbonyl)phenyl]glycinamide, Cambridge id 7188892
| Molecular Formula | C21H24ClN3O5S |
|---|---|
| Molecular Weight | 465.11 g/mol |
| LogP | 2.9893 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 465.11252 |
| Heavy Atoms | 31 |
| Complexity | 1084.1729 |
Chemical Identifiers
| CAS Number | 446056-79-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)N(CC(=O)NC2=CC=CC=C2C(=O)N3CCCC3)S(=O)(=O)C |
Product Overview
BAS 04921077 (CAS 446056-79-7), with molecular formula C21H24ClN3O5S and molecular weight 465.11 g/mol. IUPAC: 2-(5-chloro-2-methoxy-N-methylsulfonylanilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide.
Chemical Property Profile of BAS 04921077
Property Insights of BAS 04921077
The XLogP value of 2.9893 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04921077. The TPSA of 96.02 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04921077. Following Lipinski's Rule of Five, BAS 04921077 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 04921077?
The CAS number of BAS 04921077 is 446056-79-7.
What is the molecular formula of BAS 04921077?
The molecular formula of BAS 04921077 is C21H24ClN3O5S.
What is the molecular weight of BAS 04921077?
The molecular weight of BAS 04921077 is 465.11 g/mol.
Where can I buy BAS 04921077?
You can request a quote for BAS 04921077 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04921077?
Yes, KEHONG BIO provides custom synthesis services for BAS 04921077 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.