Urea, 1-allyl-2-thio-3-o-tolyl-
TL;DR: Urea, 1-allyl-2-thio-3-o-tolyl- (CAS 1204-97-3) is a chemical compound with molecular formula C11H14N2S and molecular weight 206.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylphenyl)-3-prop-2-enylthiourea
Also Known As: 1-Allyl-2-thio-3-o-tolylurea, Urea, 1-allyl-2-thio-3-o-tolyl-, 1-(2-methylphenyl)-3-(prop-2-en-1-yl)thiourea, N-allyl-N'-(2-methylphenyl)thiourea, N-allyl-N'-o-tolyl-thiourea
| Molecular Formula | C11H14N2S |
|---|---|
| Molecular Weight | 206.09 g/mol |
| LogP | 2.46742 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.08777 |
| Heavy Atoms | 14 |
| Complexity | 333.81433 |
Chemical Identifiers
| CAS Number | 1204-97-3 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=S)NCC=C |
Product Overview
Urea, 1-allyl-2-thio-3-o-tolyl- (CAS 1204-97-3), with molecular formula C11H14N2S and molecular weight 206.09 g/mol. IUPAC: 1-(2-methylphenyl)-3-prop-2-enylthiourea.
Chemical Property Profile of Urea, 1-allyl-2-thio-3-o-tolyl-
Property Insights of Urea, 1-allyl-2-thio-3-o-tolyl-
The XLogP value of 2.46742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-allyl-2-thio-3-o-tolyl-. With a topological polar surface area (TPSA) of 24.06 Ų, Urea, 1-allyl-2-thio-3-o-tolyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-allyl-2-thio-3-o-tolyl- 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 Urea, 1-allyl-2-thio-3-o-tolyl-?
The CAS number of Urea, 1-allyl-2-thio-3-o-tolyl- is 1204-97-3.
What is the molecular formula of Urea, 1-allyl-2-thio-3-o-tolyl-?
The molecular formula of Urea, 1-allyl-2-thio-3-o-tolyl- is C11H14N2S.
What is the molecular weight of Urea, 1-allyl-2-thio-3-o-tolyl-?
The molecular weight of Urea, 1-allyl-2-thio-3-o-tolyl- is 206.09 g/mol.
Where can I buy Urea, 1-allyl-2-thio-3-o-tolyl-?
You can request a quote for Urea, 1-allyl-2-thio-3-o-tolyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-allyl-2-thio-3-o-tolyl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-allyl-2-thio-3-o-tolyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.