N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate
TL;DR: N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate (CAS 338396-41-1) is a chemical compound with molecular formula C15H15N3O6S and molecular weight 365.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(4-nitrophenyl)carbamoyl]phenyl] N,N-dimethylsulfamate
Also Known As: Bionet1_000456, N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate, 2F-415S, 2-[(4-nitrophenyl)carbamoyl]phenyl N,N-dimethylsulfamate, [2-[(4-nitrophenyl)carbamoyl]phenyl] N,N-dimethylsulfamate
| Molecular Formula | C15H15N3O6S |
|---|---|
| Molecular Weight | 365.07 g/mol |
| LogP | 2.0323 |
| Topological Polar Surface Area | 118.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 365.06815 |
| Heavy Atoms | 25 |
| Complexity | 893.7377 |
Chemical Identifiers
| CAS Number | 338396-41-1 |
|---|---|
| SMILES | CN(C)S(=O)(=O)OC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate (CAS 338396-41-1), with molecular formula C15H15N3O6S and molecular weight 365.07 g/mol. IUPAC: [2-[(4-nitrophenyl)carbamoyl]phenyl] N,N-dimethylsulfamate.
Chemical Property Profile of N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate
Property Insights of N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate
The XLogP value of 2.0323 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate. The TPSA of 118.85 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate. Following Lipinski's Rule of Five, N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate has 1 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,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate?
The CAS number of N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate is 338396-41-1.
What is the molecular formula of N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate?
The molecular formula of N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate is C15H15N3O6S.
What is the molecular weight of N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate?
The molecular weight of N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate is 365.07 g/mol.
Where can I buy N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate?
You can request a quote for N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl{2-[(4-nitroanilino)carbonyl]phenyl}sulfamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.