N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester
TL;DR: N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester (CAS 338405-85-9) is a chemical compound with molecular formula C16H18N2O5S and molecular weight 350.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[(4-methoxyphenyl)carbamoyl]phenyl] N,N-dimethylsulfamate
Also Known As: Bionet1_000488, 3F-310S, [3-[(4-methoxyphenyl)carbamoyl]phenyl] N,N-dimethylsulfamate, 3-[(4-methoxyanilino)carbonyl]phenyl-N,N-dimethylsulfamate, 3-[(4-methoxyphenyl)carbamoyl]phenyl N,N-dimethylsulfamate
| Molecular Formula | C16H18N2O5S |
|---|---|
| Molecular Weight | 350.09 g/mol |
| LogP | 2.1327 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 350.09363 |
| Heavy Atoms | 24 |
| Complexity | 816.61633 |
Chemical Identifiers
| CAS Number | 338405-85-9 |
|---|---|
| SMILES | CN(C)S(=O)(=O)OC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)OC |
Product Overview
N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester (CAS 338405-85-9), with molecular formula C16H18N2O5S and molecular weight 350.09 g/mol. IUPAC: [3-[(4-methoxyphenyl)carbamoyl]phenyl] N,N-dimethylsulfamate.
Chemical Property Profile of N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester
Property Insights of N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester
The XLogP value of 2.1327 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester. Following Lipinski's Rule of Five, N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester has 1 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,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester?
The CAS number of N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester is 338405-85-9.
What is the molecular formula of N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester?
The molecular formula of N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester is C16H18N2O5S.
What is the molecular weight of N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester?
The molecular weight of N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester is 350.09 g/mol.
Where can I buy N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester?
You can request a quote for N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.