N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide
TL;DR: N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide (CAS 1024726-20-2) is a chemical compound with molecular formula C15H18N2O3S and molecular weight 306.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(2-tert-butylsulfonyl-2-cyanoethenyl)phenyl]acetamide
Also Known As: N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide, N-[4-(2-tert-butylsulfonyl-2-cyanoethenyl)phenyl]acetamide, N-[4-(2-cyano-2-tert-butylsulfonyl-ethenyl)phenyl]acetamide, N-(4-(2-((Tert-butyl)sulfonyl)-2-nitrilovinyl)phenyl)ethanamide, N-{4-[(E)-2-(tert-butylsulfonyl)-2-cyanoethenyl]phenyl}acetamide
| Molecular Formula | C15H18N2O3S |
|---|---|
| Molecular Weight | 306.10 g/mol |
| LogP | 2.72278 |
| Topological Polar Surface Area | 87.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.10382 |
| Heavy Atoms | 21 |
| Complexity | 702.771 |
Chemical Identifiers
| CAS Number | 1024726-20-2 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C=C(C#N)S(=O)(=O)C(C)(C)C |
Product Overview
N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide (CAS 1024726-20-2), with molecular formula C15H18N2O3S and molecular weight 306.10 g/mol. IUPAC: N-[4-(2-tert-butylsulfonyl-2-cyanoethenyl)phenyl]acetamide.
Chemical Property Profile of N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide
Property Insights of N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide
The XLogP value of 2.72278 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide. The TPSA of 87.03 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide. Following Lipinski's Rule of Five, N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide 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 N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide?
The CAS number of N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide is 1024726-20-2.
What is the molecular formula of N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide?
The molecular formula of N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide is C15H18N2O3S.
What is the molecular weight of N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide?
The molecular weight of N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide is 306.10 g/mol.
Where can I buy N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide?
You can request a quote for N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(2-tert-butylsulfonyl-2-cyano-vinyl)phenyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.