N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea
TL;DR: N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea (CAS 394239-57-7) is a chemical compound with molecular formula C15H13ClN2OS and molecular weight 304.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-benzoyl-4-chlorophenyl)-3-methylthiourea
Also Known As: N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea, 1-(2-benzoyl-4-chlorophenyl)-3-methylthiourea, thiourea, N-(2-benzoyl-4-chlorophenyl)-N'-methyl-, AB00119907-01, AP-845/40877869
| Molecular Formula | C15H13ClN2OS |
|---|---|
| Molecular Weight | 304.04 g/mol |
| LogP | 3.4872 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.0437 |
| Heavy Atoms | 20 |
| Complexity | 643.5767 |
Chemical Identifiers
| CAS Number | 394239-57-7 |
|---|---|
| SMILES | CNC(=S)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2 |
Product Overview
N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea (CAS 394239-57-7), with molecular formula C15H13ClN2OS and molecular weight 304.04 g/mol. IUPAC: 1-(2-benzoyl-4-chlorophenyl)-3-methylthiourea.
Chemical Property Profile of N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea
Property Insights of N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea
The XLogP value of 3.4872 indicates that N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea has 2 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-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea?
The CAS number of N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea is 394239-57-7.
What is the molecular formula of N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea?
The molecular formula of N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea is C15H13ClN2OS.
What is the molecular weight of N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea?
The molecular weight of N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea is 304.04 g/mol.
Where can I buy N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea?
You can request a quote for N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(2-benzoyl-4-chlorophenyl)-N'-methylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.