(3-Phenoxyphenyl)thiourea
TL;DR: (3-Phenoxyphenyl)thiourea (CAS 76839-22-0) is a chemical compound with molecular formula C13H12N2OS and molecular weight 244.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-phenoxyphenyl)thiourea
Also Known As: (3-phenoxyphenyl)thiourea, Thiourea, (3-phenoxyphenyl)-, N-(3-Phenoxyphenyl)thiourea, (3-Phenoxy-phenyl)-thiourea, 3-PHENOXYPHENYLTHIOUREA
| Molecular Formula | C13H12N2OS |
|---|---|
| Molecular Weight | 244.07 g/mol |
| LogP | 3.1344 |
| Topological Polar Surface Area | 47.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.06703 |
| Heavy Atoms | 17 |
| Complexity | 513.8377 |
Chemical Identifiers
| CAS Number | 76839-22-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)NC(=S)N |
Product Overview
(3-Phenoxyphenyl)thiourea (CAS 76839-22-0), with molecular formula C13H12N2OS and molecular weight 244.07 g/mol. IUPAC: (3-phenoxyphenyl)thiourea.
Chemical Property Profile of (3-Phenoxyphenyl)thiourea
Property Insights of (3-Phenoxyphenyl)thiourea
The XLogP value of 3.1344 indicates that (3-Phenoxyphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.28 Ų, (3-Phenoxyphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Phenoxyphenyl)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 (3-Phenoxyphenyl)thiourea?
The CAS number of (3-Phenoxyphenyl)thiourea is 76839-22-0.
What is the molecular formula of (3-Phenoxyphenyl)thiourea?
The molecular formula of (3-Phenoxyphenyl)thiourea is C13H12N2OS.
What is the molecular weight of (3-Phenoxyphenyl)thiourea?
The molecular weight of (3-Phenoxyphenyl)thiourea is 244.07 g/mol.
Where can I buy (3-Phenoxyphenyl)thiourea?
You can request a quote for (3-Phenoxyphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Phenoxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for (3-Phenoxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.