1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea
TL;DR: 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea (CAS 650595-03-2) is a chemical compound with molecular formula C21H18N2OS and molecular weight 346.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea
Also Known As: 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea, N-(2-methylphenyl)-N'-(9H-xanthen-9-yl)thiourea, AO-080/42479806, [(2-methylphenyl)amino](xanthen-9-ylamino)methane-1-thione
| Molecular Formula | C21H18N2OS |
|---|---|
| Molecular Weight | 346.11 g/mol |
| LogP | 5.17672 |
| Topological Polar Surface Area | 33.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 346.11398 |
| Heavy Atoms | 25 |
| Complexity | 892.93896 |
Chemical Identifiers
| CAS Number | 650595-03-2 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=S)NC2C3=CC=CC=C3OC4=CC=CC=C24 |
Product Overview
1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea (CAS 650595-03-2), with molecular formula C21H18N2OS and molecular weight 346.11 g/mol. IUPAC: 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea.
Chemical Property Profile of 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea
Property Insights of 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea
The XLogP value of 5.17672 indicates that 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.29 Ų, 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea?
The CAS number of 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea is 650595-03-2.
What is the molecular formula of 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea?
The molecular formula of 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea is C21H18N2OS.
What is the molecular weight of 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea?
The molecular weight of 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea is 346.11 g/mol.
Where can I buy 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea?
You can request a quote for 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-methylphenyl)-3-(9H-xanthen-9-yl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.