4-Cyanophenyl N-(3,5-xylyl)carbamate
TL;DR: 4-Cyanophenyl N-(3,5-xylyl)carbamate (CAS 197311-71-0) is a chemical compound with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-cyanophenyl) N-(3,5-dimethylphenyl)carbamate
Also Known As: 4-CYANOPHENYL N-(3,5-XYLYL)CARBAMATE, (4-cyanophenyl) N-(3,5-dimethylphenyl)carbamate
| Molecular Formula | C16H14N2O2 |
|---|---|
| Molecular Weight | 266.11 g/mol |
| LogP | 3.78602 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.10553 |
| Heavy Atoms | 20 |
| Complexity | 649.6165 |
Chemical Identifiers
| CAS Number | 197311-71-0 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC(=O)OC2=CC=C(C=C2)C#N)C |
Product Overview
4-Cyanophenyl N-(3,5-xylyl)carbamate (CAS 197311-71-0), with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol. IUPAC: (4-cyanophenyl) N-(3,5-dimethylphenyl)carbamate.
Chemical Property Profile of 4-Cyanophenyl N-(3,5-xylyl)carbamate
Property Insights of 4-Cyanophenyl N-(3,5-xylyl)carbamate
The XLogP value of 3.78602 indicates that 4-Cyanophenyl N-(3,5-xylyl)carbamate 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-Cyanophenyl N-(3,5-xylyl)carbamate. Following Lipinski's Rule of Five, 4-Cyanophenyl N-(3,5-xylyl)carbamate 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-Cyanophenyl N-(3,5-xylyl)carbamate?
The CAS number of 4-Cyanophenyl N-(3,5-xylyl)carbamate is 197311-71-0.
What is the molecular formula of 4-Cyanophenyl N-(3,5-xylyl)carbamate?
The molecular formula of 4-Cyanophenyl N-(3,5-xylyl)carbamate is C16H14N2O2.
What is the molecular weight of 4-Cyanophenyl N-(3,5-xylyl)carbamate?
The molecular weight of 4-Cyanophenyl N-(3,5-xylyl)carbamate is 266.11 g/mol.
Where can I buy 4-Cyanophenyl N-(3,5-xylyl)carbamate?
You can request a quote for 4-Cyanophenyl N-(3,5-xylyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Cyanophenyl N-(3,5-xylyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for 4-Cyanophenyl N-(3,5-xylyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.