Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate
TL;DR: Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate (CAS 98992-11-1) is a chemical compound with molecular formula C19H18N2O3 and molecular weight 322.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[cyano-(3-phenoxyphenyl)methyl] N-cyclobutylcarbamate
Also Known As: Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate, [cyano-(3-phenoxyphenyl)methyl] N-cyclobutylcarbamate, Carbamic acid, N-cyclobutyl-, cyano(3-phenoxyphenyl)methyl ester, Cyano(3-phenoxyphenyl)methyl hydrogen cyclobutylcarbonimidate
| Molecular Formula | C19H18N2O3 |
|---|---|
| Molecular Weight | 322.13 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 322.13174 |
| Heavy Atoms | 24 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 98992-11-1 |
|---|---|
| SMILES | C1CC(C1)NC(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3 |
| InChIKey | UYLUOORBDQFYOA-UHFFFAOYSA-N |
Product Overview
Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate (CAS 98992-11-1), with molecular formula C19H18N2O3 and molecular weight 322.13 g/mol. IUPAC: [cyano-(3-phenoxyphenyl)methyl] N-cyclobutylcarbamate.
Chemical Property Profile of Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate
Property Insights of Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate
The XLogP value of 4.3 indicates that Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate. Following Lipinski's Rule of Five, Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate has 1 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 Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate?
The CAS number of Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate is 98992-11-1.
What is the molecular formula of Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate?
The molecular formula of Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate is C19H18N2O3.
What is the molecular weight of Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate?
The molecular weight of Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate is 322.13 g/mol.
Where can I buy Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate?
You can request a quote for Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Cyano(3-phenoxyphenyl)methyl N-cyclobutylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.