4-(Cyanomethyl)Phenyl N-Phenylcarbamate
TL;DR: 4-(Cyanomethyl)Phenyl N-Phenylcarbamate (CAS 175135-37-2) is a chemical compound with molecular formula C15H12N2O2 and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(cyanomethyl)phenyl] N-phenylcarbamate
Also Known As: 4-(Cyanomethyl)Phenyl N-Phenylcarbamate, Maybridge1_001855, 3,4-Furandicarboxylic acid, [4-(cyanomethyl)phenyl] N-phenylcarbamate, 4-(Cyanomethyl)phenyl phenylcarbamate
| Molecular Formula | C15H12N2O2 |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 3.36358 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.08987 |
| Heavy Atoms | 19 |
| Complexity | 585.79266 |
Chemical Identifiers
| CAS Number | 175135-37-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)OC2=CC=C(C=C2)CC#N |
Product Overview
4-(Cyanomethyl)Phenyl N-Phenylcarbamate (CAS 175135-37-2), with molecular formula C15H12N2O2 and molecular weight 252.09 g/mol. IUPAC: [4-(cyanomethyl)phenyl] N-phenylcarbamate.
Chemical Property Profile of 4-(Cyanomethyl)Phenyl N-Phenylcarbamate
Property Insights of 4-(Cyanomethyl)Phenyl N-Phenylcarbamate
The XLogP value of 3.36358 indicates that 4-(Cyanomethyl)Phenyl N-Phenylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Cyanomethyl)Phenyl N-Phenylcarbamate. Following Lipinski's Rule of Five, 4-(Cyanomethyl)Phenyl N-Phenylcarbamate has 1 hydrogen bond donor(s) and 3 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-(Cyanomethyl)Phenyl N-Phenylcarbamate?
The CAS number of 4-(Cyanomethyl)Phenyl N-Phenylcarbamate is 175135-37-2.
What is the molecular formula of 4-(Cyanomethyl)Phenyl N-Phenylcarbamate?
The molecular formula of 4-(Cyanomethyl)Phenyl N-Phenylcarbamate is C15H12N2O2.
What is the molecular weight of 4-(Cyanomethyl)Phenyl N-Phenylcarbamate?
The molecular weight of 4-(Cyanomethyl)Phenyl N-Phenylcarbamate is 252.09 g/mol.
Where can I buy 4-(Cyanomethyl)Phenyl N-Phenylcarbamate?
You can request a quote for 4-(Cyanomethyl)Phenyl N-Phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Cyanomethyl)Phenyl N-Phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Cyanomethyl)Phenyl N-Phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.