N,N-diallyl-N'-(2-chlorobenzoyl)thiourea
TL;DR: N,N-diallyl-N'-(2-chlorobenzoyl)thiourea (CAS 791792-35-3) is a chemical compound with molecular formula C14H15ClN2OS and molecular weight 294.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[bis(prop-2-enyl)carbamothioyl]-2-chlorobenzamide
Also Known As: N,N-diallyl-N'-(2-chlorobenzoyl)thiourea, N,N-Diallyl-N/'-(2-chlorobenzoyl)thiourea, 2-chloro-N-[(diallylamino)carbonothioyl]benzamide, N-[bis(prop-2-enyl)carbamothioyl]-2-chlorobenzamide, AN-329/42607851
| Molecular Formula | C14H15ClN2OS |
|---|---|
| Molecular Weight | 294.06 g/mol |
| LogP | 3.0287 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.05936 |
| Heavy Atoms | 19 |
| Complexity | 491.97427 |
Chemical Identifiers
| CAS Number | 791792-35-3 |
|---|---|
| SMILES | C=CCN(CC=C)C(=S)NC(=O)C1=CC=CC=C1Cl |
Product Overview
N,N-diallyl-N'-(2-chlorobenzoyl)thiourea (CAS 791792-35-3), with molecular formula C14H15ClN2OS and molecular weight 294.06 g/mol. IUPAC: N-[bis(prop-2-enyl)carbamothioyl]-2-chlorobenzamide.
Chemical Property Profile of N,N-diallyl-N'-(2-chlorobenzoyl)thiourea
Property Insights of N,N-diallyl-N'-(2-chlorobenzoyl)thiourea
The XLogP value of 3.0287 indicates that N,N-diallyl-N'-(2-chlorobenzoyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.34 Ų, N,N-diallyl-N'-(2-chlorobenzoyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diallyl-N'-(2-chlorobenzoyl)thiourea has 1 hydrogen bond donor(s) and 2 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 N,N-diallyl-N'-(2-chlorobenzoyl)thiourea?
The CAS number of N,N-diallyl-N'-(2-chlorobenzoyl)thiourea is 791792-35-3.
What is the molecular formula of N,N-diallyl-N'-(2-chlorobenzoyl)thiourea?
The molecular formula of N,N-diallyl-N'-(2-chlorobenzoyl)thiourea is C14H15ClN2OS.
What is the molecular weight of N,N-diallyl-N'-(2-chlorobenzoyl)thiourea?
The molecular weight of N,N-diallyl-N'-(2-chlorobenzoyl)thiourea is 294.06 g/mol.
Where can I buy N,N-diallyl-N'-(2-chlorobenzoyl)thiourea?
You can request a quote for N,N-diallyl-N'-(2-chlorobenzoyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diallyl-N'-(2-chlorobenzoyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N,N-diallyl-N'-(2-chlorobenzoyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.