3-Acetylphenylthiourea
TL;DR: 3-Acetylphenylthiourea (CAS 86801-04-9) is a chemical compound with molecular formula C9H10N2OS and molecular weight 194.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetylphenyl)thiourea
Also Known As: 1-(3-Acetylphenyl)-2-thiourea, 3-Acetylphenylthiourea, 1-(3-acetylphenyl)thiourea, (3-acetylphenyl)thiourea, N-(3-Acetylphenyl)thiourea
| Molecular Formula | C9H10N2OS |
|---|---|
| Molecular Weight | 194.05 g/mol |
| LogP | 1.5447 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.05139 |
| Heavy Atoms | 13 |
| Complexity | 349.22287 |
Chemical Identifiers
| CAS Number | 86801-04-9 |
|---|---|
| SMILES | CC(=O)C1=CC(=CC=C1)NC(=S)N |
Product Overview
3-Acetylphenylthiourea (CAS 86801-04-9), with molecular formula C9H10N2OS and molecular weight 194.05 g/mol. IUPAC: (3-acetylphenyl)thiourea.
Chemical Property Profile of 3-Acetylphenylthiourea
Property Insights of 3-Acetylphenylthiourea
The XLogP value of 1.5447 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetylphenylthiourea. With a topological polar surface area (TPSA) of 55.12 Ų, 3-Acetylphenylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Acetylphenylthiourea 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 3-Acetylphenylthiourea?
The CAS number of 3-Acetylphenylthiourea is 86801-04-9.
What is the molecular formula of 3-Acetylphenylthiourea?
The molecular formula of 3-Acetylphenylthiourea is C9H10N2OS.
What is the molecular weight of 3-Acetylphenylthiourea?
The molecular weight of 3-Acetylphenylthiourea is 194.05 g/mol.
Where can I buy 3-Acetylphenylthiourea?
You can request a quote for 3-Acetylphenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetylphenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetylphenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.