N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide
TL;DR: N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide (CAS 886493-59-0) is a chemical compound with molecular formula C14H14N2O5S and molecular weight 322.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(hydroxymethyl)-4-nitrophenyl]-4-methylbenzenesulfonamide
Also Known As: N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide, N-[2-(hydroxymethyl)-4-nitrophenyl]-4-methylbenzenesulfonamide, N-(2-Hydroxymethyl-4-nitro-phenyl)-4-methyl-benzenesulfonamide
| Molecular Formula | C14H14N2O5S |
|---|---|
| Molecular Weight | 322.06 g/mol |
| LogP | 2.19632 |
| Topological Polar Surface Area | 109.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.06235 |
| Heavy Atoms | 22 |
| Complexity | 800.483 |
Chemical Identifiers
| CAS Number | 886493-59-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])CO |
Product Overview
N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide (CAS 886493-59-0), with molecular formula C14H14N2O5S and molecular weight 322.06 g/mol. IUPAC: N-[2-(hydroxymethyl)-4-nitrophenyl]-4-methylbenzenesulfonamide.
Chemical Property Profile of N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide
Property Insights of N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide
The XLogP value of 2.19632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide. The TPSA of 109.54 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide has 2 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-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide?
The CAS number of N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide is 886493-59-0.
What is the molecular formula of N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide?
The molecular formula of N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide is C14H14N2O5S.
What is the molecular weight of N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide?
The molecular weight of N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide is 322.06 g/mol.
Where can I buy N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide?
You can request a quote for N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-(Hydroxymethyl)-4-nitrophenyl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.