4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate
TL;DR: 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate (CAS 501104-71-8) is a chemical compound with molecular formula C18H18ClNO3 and molecular weight 331.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-chlorobenzoyl)phenyl] N,N-diethylcarbamate
Also Known As: 4-(4-chlorobenzoyl)phenyl diethylcarbamate, 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate, [4-(4-chlorobenzoyl)phenyl] N,N-diethylcarbamate, {4-[(4-chlorophenyl)carbonyl]phenoxy}-N,N-diethylcarboxamide
| Molecular Formula | C18H18ClNO3 |
|---|---|
| Molecular Weight | 331.10 g/mol |
| LogP | 4.4116 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.09753 |
| Heavy Atoms | 23 |
| Complexity | 676.4178 |
Chemical Identifiers
| CAS Number | 501104-71-8 |
|---|---|
| SMILES | CCN(CC)C(=O)OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl |
Product Overview
4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate (CAS 501104-71-8), with molecular formula C18H18ClNO3 and molecular weight 331.10 g/mol. IUPAC: [4-(4-chlorobenzoyl)phenyl] N,N-diethylcarbamate.
Chemical Property Profile of 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate
Property Insights of 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate
The XLogP value of 4.4116 indicates that 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate has 0 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-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate?
The CAS number of 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate is 501104-71-8.
What is the molecular formula of 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate?
The molecular formula of 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate is C18H18ClNO3.
What is the molecular weight of 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate?
The molecular weight of 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate is 331.10 g/mol.
Where can I buy 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate?
You can request a quote for 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-chlorobenzoyl)phenyl N,N-diethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.