(4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate
TL;DR: (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate (CAS 2204-77-5) is a chemical compound with molecular formula C14H8Cl2N2O2 and molecular weight 306.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate
Also Known As: (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate, 4-cyanophenyl 3,4-dichlorophenylcarbamate, 4-Cyanophenyl (3,4-dichlorophenyl)carbamate
| Molecular Formula | C14H8Cl2N2O2 |
|---|---|
| Molecular Weight | 306.00 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 62.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.99628 |
| Heavy Atoms | 20 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 2204-77-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)OC(=O)NC2=CC(=C(C=C2)Cl)Cl |
| InChIKey | QEWSVWTVNSZJCB-UHFFFAOYSA-N |
Product Overview
(4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate (CAS 2204-77-5), with molecular formula C14H8Cl2N2O2 and molecular weight 306.00 g/mol. IUPAC: (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate.
Chemical Property Profile of (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate
Property Insights of (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate
The XLogP value of 4.8 indicates that (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate. Following Lipinski's Rule of Five, (4-cyanophenyl) N-(3,4-dichlorophenyl)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-(3,4-dichlorophenyl)carbamate?
The CAS number of (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate is 2204-77-5.
What is the molecular formula of (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate?
The molecular formula of (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate is C14H8Cl2N2O2.
What is the molecular weight of (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate?
The molecular weight of (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate is 306.00 g/mol.
Where can I buy (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate?
You can request a quote for (4-cyanophenyl) N-(3,4-dichlorophenyl)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-(3,4-dichlorophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for (4-cyanophenyl) N-(3,4-dichlorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.