Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester
TL;DR: Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester (CAS 98992-12-2) is a chemical compound with molecular formula C20H20N2O3 and molecular weight 336.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[cyano-(3-phenoxyphenyl)methyl] N-cyclopentylcarbamate
Also Known As: Cyano(3-phenoxyphenyl)methyl) N-cyclopentylcarbamate, Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester, [cyano-(3-phenoxyphenyl)methyl] N-cyclopentylcarbamate, Carbamic acid, cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester, Cyano(3-phenoxyphenyl)methyl hydrogen cyclopentylcarbonimidate
| Molecular Formula | C20H20N2O3 |
|---|---|
| Molecular Weight | 336.15 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.1474 |
| Heavy Atoms | 25 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 98992-12-2 |
|---|---|
| SMILES | C1CCC(C1)NC(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3 |
| InChIKey | PMOCRVTYJUXYOY-UHFFFAOYSA-N |
Product Overview
Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester (CAS 98992-12-2), with molecular formula C20H20N2O3 and molecular weight 336.15 g/mol. IUPAC: [cyano-(3-phenoxyphenyl)methyl] N-cyclopentylcarbamate.
Chemical Property Profile of Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester
Property Insights of Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester
The XLogP value of 4.7 indicates that Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester 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 Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester. Following Lipinski's Rule of Five, Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester 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 Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester?
The CAS number of Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester is 98992-12-2.
What is the molecular formula of Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester?
The molecular formula of Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester is C20H20N2O3.
What is the molecular weight of Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester?
The molecular weight of Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester is 336.15 g/mol.
Where can I buy Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester?
You can request a quote for Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, N-cyclopentyl-, cyano(3-phenoxyphenyl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.