1-Phenyl-3-(2,6-xylyl)-2-thiourea
TL;DR: 1-Phenyl-3-(2,6-xylyl)-2-thiourea (CAS 25347-93-7) is a chemical compound with molecular formula C15H16N2S and molecular weight 256.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dimethylphenyl)-3-phenylthiourea
Also Known As: 1-(2,6-dimethylphenyl)-3-phenylthiourea, 1-phenyl-3-(2,6-xylyl)-2-thiourea, 1-Phenyl-3-(2,6-dimethylphenyl)thiourea, N-(2,6-Dimethylphenyl)-N'-phenylthiourea, J2.602.353J
| Molecular Formula | C15H16N2S |
|---|---|
| Molecular Weight | 256.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.10342 |
| Heavy Atoms | 18 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 25347-93-7 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=S)NC2=CC=CC=C2 |
| InChIKey | FXEJNAAFZARADY-UHFFFAOYSA-N |
Product Overview
1-Phenyl-3-(2,6-xylyl)-2-thiourea (CAS 25347-93-7), with molecular formula C15H16N2S and molecular weight 256.10 g/mol. IUPAC: 1-(2,6-dimethylphenyl)-3-phenylthiourea.
Chemical Property Profile of 1-Phenyl-3-(2,6-xylyl)-2-thiourea
Property Insights of 1-Phenyl-3-(2,6-xylyl)-2-thiourea
The XLogP value of 3.8 indicates that 1-Phenyl-3-(2,6-xylyl)-2-thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.2 Ų, 1-Phenyl-3-(2,6-xylyl)-2-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-3-(2,6-xylyl)-2-thiourea has 2 hydrogen bond donor(s) and 1 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-Phenyl-3-(2,6-xylyl)-2-thiourea?
The CAS number of 1-Phenyl-3-(2,6-xylyl)-2-thiourea is 25347-93-7.
What is the molecular formula of 1-Phenyl-3-(2,6-xylyl)-2-thiourea?
The molecular formula of 1-Phenyl-3-(2,6-xylyl)-2-thiourea is C15H16N2S.
What is the molecular weight of 1-Phenyl-3-(2,6-xylyl)-2-thiourea?
The molecular weight of 1-Phenyl-3-(2,6-xylyl)-2-thiourea is 256.10 g/mol.
Where can I buy 1-Phenyl-3-(2,6-xylyl)-2-thiourea?
You can request a quote for 1-Phenyl-3-(2,6-xylyl)-2-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-3-(2,6-xylyl)-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-(2,6-xylyl)-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.