1-Benzoyl-3-cyclopropylmethyl-thiourea
TL;DR: 1-Benzoyl-3-cyclopropylmethyl-thiourea (CAS 229636-55-9) is a chemical compound with molecular formula C12H14N2OS and molecular weight 234.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyclopropylmethylcarbamothioyl)benzamide
Also Known As: 1-Benzoyl-3-cyclopropylmethyl-thiourea, N-(cyclopropylmethylcarbamothioyl)benzamide, Benzamide, N-[[(cyclopropylmethyl)amino]thioxomethyl]-
| Molecular Formula | C12H14N2OS |
|---|---|
| Molecular Weight | 234.08 g/mol |
| LogP | 1.7009 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.08269 |
| Heavy Atoms | 16 |
| Complexity | 387.26505 |
Chemical Identifiers
| CAS Number | 229636-55-9 |
|---|---|
| SMILES | C1CC1CNC(=S)NC(=O)C2=CC=CC=C2 |
Product Overview
1-Benzoyl-3-cyclopropylmethyl-thiourea (CAS 229636-55-9), with molecular formula C12H14N2OS and molecular weight 234.08 g/mol. IUPAC: N-(cyclopropylmethylcarbamothioyl)benzamide.
Chemical Property Profile of 1-Benzoyl-3-cyclopropylmethyl-thiourea
Property Insights of 1-Benzoyl-3-cyclopropylmethyl-thiourea
The XLogP value of 1.7009 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzoyl-3-cyclopropylmethyl-thiourea. With a topological polar surface area (TPSA) of 41.13 Ų, 1-Benzoyl-3-cyclopropylmethyl-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzoyl-3-cyclopropylmethyl-thiourea 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 1-Benzoyl-3-cyclopropylmethyl-thiourea?
The CAS number of 1-Benzoyl-3-cyclopropylmethyl-thiourea is 229636-55-9.
What is the molecular formula of 1-Benzoyl-3-cyclopropylmethyl-thiourea?
The molecular formula of 1-Benzoyl-3-cyclopropylmethyl-thiourea is C12H14N2OS.
What is the molecular weight of 1-Benzoyl-3-cyclopropylmethyl-thiourea?
The molecular weight of 1-Benzoyl-3-cyclopropylmethyl-thiourea is 234.08 g/mol.
Where can I buy 1-Benzoyl-3-cyclopropylmethyl-thiourea?
You can request a quote for 1-Benzoyl-3-cyclopropylmethyl-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzoyl-3-cyclopropylmethyl-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzoyl-3-cyclopropylmethyl-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.