![N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide structure](/static/products/895/895840-69-4.png)
N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide
TL;DR: N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide (CAS 895840-69-4) is a chemical compound with molecular formula C16H14N4O5S and molecular weight 374.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-nitrobenzenesulfonamide
Also Known As: 2-nitro-N-((3-(m-tolyl)-1,2,4-oxadiazol-5-yl)methyl)benzenesulfonamide, N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-nitrobenzenesulfonamide, N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide
| Molecular Formula | C16H14N4O5S |
|---|---|
| Molecular Weight | 374.07 g/mol |
| LogP | 2.43172 |
| Topological Polar Surface Area | 128.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 374.06848 |
| Heavy Atoms | 26 |
| Complexity | 1061.7618 |
Chemical Identifiers
| CAS Number | 895840-69-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NOC(=N2)CNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide (CAS 895840-69-4), with molecular formula C16H14N4O5S and molecular weight 374.07 g/mol. IUPAC: N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-nitrobenzenesulfonamide.
Chemical Property Profile of N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide
Property Insights of N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide
The XLogP value of 2.43172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide. The TPSA of 128.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide has 1 hydrogen bond donor(s) and 7 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-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide?
The CAS number of N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide is 895840-69-4.
What is the molecular formula of N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide?
The molecular formula of N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide is C16H14N4O5S.
What is the molecular weight of N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide?
The molecular weight of N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide is 374.07 g/mol.
Where can I buy N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide?
You can request a quote for N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.