![n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide structure](/static/products/498/49865-39-6.png)
n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide
TL;DR: n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide (CAS 49865-39-6) is a chemical compound with molecular formula C20H16ClN3O4S and molecular weight 429.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(E)-[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenyl]-N-(2-cyanoethyl)methanesulfonamide
Also Known As: n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide, N-[4-[(E)-[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenyl]-N-(2-cyanoethyl)methanesulfonamide
| Molecular Formula | C20H16ClN3O4S |
|---|---|
| Molecular Weight | 429.06 g/mol |
| LogP | 3.36418 |
| Topological Polar Surface Area | 99.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.055 |
| Heavy Atoms | 29 |
| Complexity | 1148.9939 |
Chemical Identifiers
| CAS Number | 49865-39-6 |
|---|---|
| SMILES | CS(=O)(=O)N(CCC#N)C1=CC=C(C=C1)/C=C/2\C(=O)OC(=N2)C3=CC=CC=C3Cl |
Product Overview
n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide (CAS 49865-39-6), with molecular formula C20H16ClN3O4S and molecular weight 429.06 g/mol. IUPAC: N-[4-[(E)-[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenyl]-N-(2-cyanoethyl)methanesulfonamide.
Chemical Property Profile of n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide
Property Insights of n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide
The XLogP value of 3.36418 indicates that n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.83 Ų falls within the moderate polarity range, balancing permeability and solubility for n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide. Following Lipinski's Rule of Five, n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide has 0 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 n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide?
The CAS number of n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide is 49865-39-6.
What is the molecular formula of n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide?
The molecular formula of n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide is C20H16ClN3O4S.
What is the molecular weight of n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide?
The molecular weight of n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide is 429.06 g/mol.
Where can I buy n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide?
You can request a quote for n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide 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-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for n-(4-{[2-(2-chlorophenyl)-5-oxo-1,3-oxazol-4(5h)-ylidene]methyl}phenyl)-n-(2-cyanoethyl)methanesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.