Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-
TL;DR: Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl- (CAS 149485-35-8) is a chemical compound with molecular formula C12H14N4S and molecular weight 246.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-phenylethyl)-3-(1H-pyrazol-5-yl)thiourea
Also Known As: PETT Analog 47, PETT Pyrazol deriv., Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-, 1-phenethyl-3-(1H-pyrazol-3-yl)thiourea, 1-phenethyl-3-(1H-pyrazol-5-yl)thiourea
| Molecular Formula | C12H14N4S |
|---|---|
| Molecular Weight | 246.09 g/mol |
| LogP | 1.9388 |
| Topological Polar Surface Area | 52.74 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.09392 |
| Heavy Atoms | 17 |
| Complexity | 452.62256 |
Chemical Identifiers
| CAS Number | 149485-35-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC(=S)NC2=CC=NN2 |
Product Overview
Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl- (CAS 149485-35-8), with molecular formula C12H14N4S and molecular weight 246.09 g/mol. IUPAC: 1-(2-phenylethyl)-3-(1H-pyrazol-5-yl)thiourea.
Chemical Property Profile of Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-
Property Insights of Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-
The XLogP value of 1.9388 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-. With a topological polar surface area (TPSA) of 52.74 Ų, Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl- has 3 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 Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-?
The CAS number of Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl- is 149485-35-8.
What is the molecular formula of Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-?
The molecular formula of Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl- is C12H14N4S.
What is the molecular weight of Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-?
The molecular weight of Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl- is 246.09 g/mol.
Where can I buy Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-?
You can request a quote for Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl-?
Yes, KEHONG BIO provides custom synthesis services for Thiourea, N-(2-phenylethyl)-N'-1H-pyrazol-3-yl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.