4-硝基苯基甲基苯基氨基甲酸
TL;DR: 4-硝基苯基甲基苯基氨基甲酸 (CAS 49839-35-2) is a chemical compound with molecular formula C14H12N2O4 and molecular weight 272.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-硝基苯基甲基苯基氨基甲酸
(4-nitrophenyl) N-methyl-N-phenylcarbamate
Also Known As: 4-Nitrophenyl methylphenylcarbamic acid, 4-nitrophenyl methyl(phenyl)carbamate, (4-nitrophenyl) N-methyl-N-phenylcarbamate, (4-nitrophenyl) N-methyl-N-phenyl-carbamate, N-methyl(4-nitrophenoxy)-N-benzamide
| Molecular Formula | C14H12N2O4 |
|---|---|
| Molecular Weight | 272.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.0797 |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 49839-35-2 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | LXZKDOSRDVBNCF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-硝基苯基甲基苯基氨基甲酸 (CAS 49839-35-2), with molecular formula C14H12N2O4 and molecular weight 272.08 g/mol. IUPAC: (4-nitrophenyl) N-methyl-N-phenylcarbamate.
Chemical Property Profile of 4-硝基苯基甲基苯基氨基甲酸
Property Insights of 4-硝基苯基甲基苯基氨基甲酸
The XLogP value of 3.1 indicates that 4-硝基苯基甲基苯基氨基甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-硝基苯基甲基苯基氨基甲酸. Following Lipinski's Rule of Five, 4-硝基苯基甲基苯基氨基甲酸 has 0 hydrogen bond donor(s) and 4 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 4-硝基苯基甲基苯基氨基甲酸?
The CAS number of 4-硝基苯基甲基苯基氨基甲酸 is 49839-35-2.
What is the molecular formula of 4-硝基苯基甲基苯基氨基甲酸?
The molecular formula of 4-硝基苯基甲基苯基氨基甲酸 is C14H12N2O4.
What is the molecular weight of 4-硝基苯基甲基苯基氨基甲酸?
The molecular weight of 4-硝基苯基甲基苯基氨基甲酸 is 272.08 g/mol.
Where can I buy 4-硝基苯基甲基苯基氨基甲酸?
You can request a quote for 4-硝基苯基甲基苯基氨基甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-硝基苯基甲基苯基氨基甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-硝基苯基甲基苯基氨基甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.