1-Methyl-1-phenyl-3-benzoylthiourea
TL;DR: 1-Methyl-1-phenyl-3-benzoylthiourea (CAS 4949-94-4) is a chemical compound with molecular formula C15H14N2OS and molecular weight 270.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[methyl(phenyl)carbamothioyl]benzamide
Also Known As: MPBTU, 1-Methyl-1-phenyl-3-benzoylthiourea, N-[methyl(phenyl)carbamothioyl]benzamide, N'-benzoyl-N-methyl-N-phenylthiourea, N-methylphenyl-N'-benzoylthiourea
| Molecular Formula | C15H14N2OS |
|---|---|
| Molecular Weight | 270.08 g/mol |
| LogP | 2.8377 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.08267 |
| Heavy Atoms | 19 |
| Complexity | 569.2142 |
Chemical Identifiers
| CAS Number | 4949-94-4 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=S)NC(=O)C2=CC=CC=C2 |
Product Overview
1-Methyl-1-phenyl-3-benzoylthiourea (CAS 4949-94-4), with molecular formula C15H14N2OS and molecular weight 270.08 g/mol. IUPAC: N-[methyl(phenyl)carbamothioyl]benzamide.
Chemical Property Profile of 1-Methyl-1-phenyl-3-benzoylthiourea
Property Insights of 1-Methyl-1-phenyl-3-benzoylthiourea
The XLogP value of 2.8377 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-1-phenyl-3-benzoylthiourea. With a topological polar surface area (TPSA) of 32.34 Ų, 1-Methyl-1-phenyl-3-benzoylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-1-phenyl-3-benzoylthiourea 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 1-Methyl-1-phenyl-3-benzoylthiourea?
The CAS number of 1-Methyl-1-phenyl-3-benzoylthiourea is 4949-94-4.
What is the molecular formula of 1-Methyl-1-phenyl-3-benzoylthiourea?
The molecular formula of 1-Methyl-1-phenyl-3-benzoylthiourea is C15H14N2OS.
What is the molecular weight of 1-Methyl-1-phenyl-3-benzoylthiourea?
The molecular weight of 1-Methyl-1-phenyl-3-benzoylthiourea is 270.08 g/mol.
Where can I buy 1-Methyl-1-phenyl-3-benzoylthiourea?
You can request a quote for 1-Methyl-1-phenyl-3-benzoylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-1-phenyl-3-benzoylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-1-phenyl-3-benzoylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.