Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester
TL;DR: Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester (CAS 123312-16-3) is a chemical compound with molecular formula C22H17ClN2O3 and molecular weight 392.09277 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[cyano-(3-phenoxyphenyl)methyl] N-[(4-chlorophenyl)methyl]carbamate
Also Known As: Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester, [cyano-(3-phenoxyphenyl)methyl] N-[(4-chlorophenyl)methyl]carbamate, Cyano(3-phenoxyphenyl)methyl hydrogen [(4-chlorophenyl)methyl]carbonimidate
Technical Specifications
| Molecular Formula | C22H17ClN2O3 |
| Molecular Weight | 392.09277 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.09277 Da |
| Heavy Atoms | 28 |
| Complexity | 535.0 |
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)C(C#N)OC(=O)NCC3=CC=C(C=C3)Cl |
| InChIKey | SJADBYYOVBWZHN-UHFFFAOYSA-N |
Chemical Property Profile of Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester
Property Insights of Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester
The XLogP value of 4.6 indicates that Carbamic acid, (4-chlorobenzyl)-, 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, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester. Following Lipinski's Rule of Five, Carbamic acid, (4-chlorobenzyl)-, 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
What is the CAS number of Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester?
The CAS number of Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester is 123312-16-3.
What is the molecular formula of Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester?
The molecular formula of Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester is C22H17ClN2O3.
What is the molecular weight of Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester?
The molecular weight of Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester is 392.09277 g/mol.
Where can I buy Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester?
You can request a quote for Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester?
Yes, CoreyChem provides custom synthesis services for Carbamic acid, (4-chlorobenzyl)-, cyano(3-phenoxyphenyl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.