N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide
TL;DR: N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide (CAS 891403-06-8) is a chemical compound with molecular formula C19H18ClN3O3S and molecular weight 403.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-prop-2-enylbenzenesulfonamide
Also Known As: N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide, 4-chloro-N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-prop-2-enylbenzenesulfonamide, 4-CHLORO-N-{[3-(4-METHYLPHENYL)-1,2,4-OXADIAZOL-5-YL]METHYL}-N-(PROP-2-EN-1-YL)BENZENE-1-SULFONAMIDE, 4-chloro-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-(prop-2-en-1-yl)benzenesulfonamide
| Molecular Formula | C19H18ClN3O3S |
|---|---|
| Molecular Weight | 403.08 g/mol |
| LogP | 4.07532 |
| Topological Polar Surface Area | 76.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 403.07574 |
| Heavy Atoms | 27 |
| Complexity | 1028.8217 |
Chemical Identifiers
| CAS Number | 891403-06-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NOC(=N2)CN(CC=C)S(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide (CAS 891403-06-8), with molecular formula C19H18ClN3O3S and molecular weight 403.08 g/mol. IUPAC: 4-chloro-N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-prop-2-enylbenzenesulfonamide.
Chemical Property Profile of N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide
Property Insights of N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide
The XLogP value of 4.07532 indicates that N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide. Following Lipinski's Rule of Five, N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide has 0 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 N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide?
The CAS number of N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide is 891403-06-8.
What is the molecular formula of N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide?
The molecular formula of N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide is C19H18ClN3O3S.
What is the molecular weight of N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide?
The molecular weight of N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide is 403.08 g/mol.
Where can I buy N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide?
You can request a quote for N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-4-chloro-N-((3-(p-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.