Benzoylthiourea
TL;DR: Benzoylthiourea (CAS 614-23-3) is a chemical compound with molecular formula C8H8N2OS and molecular weight 180.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-carbamothioylbenzamide
Also Known As: Benzoylthiourea, N-Benzoylthiourea, N-carbamothioylbenzamide, 1-Benzoyl-2-thiourea, Necacyl
| Molecular Formula | C8H8N2OS |
|---|---|
| Molecular Weight | 180.04 g/mol |
| LogP | 0.66 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.03574 |
| Heavy Atoms | 12 |
| Complexity | 297.18597 |
Chemical Identifiers
| CAS Number | 614-23-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(=S)N |
Product Overview
Benzoylthiourea (CAS 614-23-3), with molecular formula C8H8N2OS and molecular weight 180.04 g/mol. IUPAC: N-carbamothioylbenzamide.
Chemical Property Profile of Benzoylthiourea
Property Insights of Benzoylthiourea
The XLogP value of 0.66 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoylthiourea. With a topological polar surface area (TPSA) of 55.12 Ų, Benzoylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoylthiourea 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 Benzoylthiourea?
The CAS number of Benzoylthiourea is 614-23-3.
What is the molecular formula of Benzoylthiourea?
The molecular formula of Benzoylthiourea is C8H8N2OS.
What is the molecular weight of Benzoylthiourea?
The molecular weight of Benzoylthiourea is 180.04 g/mol.
Where can I buy Benzoylthiourea?
You can request a quote for Benzoylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoylthiourea?
Yes, KEHONG BIO provides custom synthesis services for Benzoylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.