Benzylphenylcarbamyl chloride
TL;DR: Benzylphenylcarbamyl chloride (CAS 108749-74-2) is a chemical compound with molecular formula C14H12ClNO and molecular weight 245.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-phenylcarbamoyl chloride
Also Known As: benzylphenylcarbamyl chloride, benzyl(phenyl)carbamic chloride, benzylphenylcarbamoyl chloride, Carbamic chloride, phenyl(phenylmethyl)-, Benzyl(phenyl)carbamoyl chloride
| Molecular Formula | C14H12ClNO |
|---|---|
| Molecular Weight | 245.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.06075 |
| Heavy Atoms | 17 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 108749-74-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)Cl |
| InChIKey | KVNPRHJSNCFLEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzylphenylcarbamyl chloride (CAS 108749-74-2), with molecular formula C14H12ClNO and molecular weight 245.06 g/mol. IUPAC: N-benzyl-N-phenylcarbamoyl chloride.
Chemical Property Profile of Benzylphenylcarbamyl chloride
Property Insights of Benzylphenylcarbamyl chloride
The XLogP value of 3.8 indicates that Benzylphenylcarbamyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, Benzylphenylcarbamyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylphenylcarbamyl chloride has 0 hydrogen bond donor(s) and 1 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 Benzylphenylcarbamyl chloride?
The CAS number of Benzylphenylcarbamyl chloride is 108749-74-2.
What is the molecular formula of Benzylphenylcarbamyl chloride?
The molecular formula of Benzylphenylcarbamyl chloride is C14H12ClNO.
What is the molecular weight of Benzylphenylcarbamyl chloride?
The molecular weight of Benzylphenylcarbamyl chloride is 245.06 g/mol.
Where can I buy Benzylphenylcarbamyl chloride?
You can request a quote for Benzylphenylcarbamyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylphenylcarbamyl chloride?
Yes, KEHONG BIO provides custom synthesis services for Benzylphenylcarbamyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.