1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea
TL;DR: 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea (CAS 652965-51-0) is a chemical compound with molecular formula C14H22N2S and molecular weight 250.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-3-(4-propan-2-ylphenyl)thiourea
Also Known As: 1-tert-butyl-3-(4-propan-2-ylphenyl)thiourea, 1-tert-butyl-3-[4-(propan-2-yl)phenyl]thiourea, N-(TERT-BUTYL)-N'-(4-ISOPROPYLPHENYL)THIOUREA, [(tert-butyl)amino]{[4-(methylethyl)phenyl]amino}methane-1-thione
| Molecular Formula | C14H22N2S |
|---|---|
| Molecular Weight | 250.15 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.15038 |
| Heavy Atoms | 17 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 652965-51-0 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)NC(=S)NC(C)(C)C |
| InChIKey | JSLAIRJDYUFPBS-UHFFFAOYSA-N |
Product Overview
1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea (CAS 652965-51-0), with molecular formula C14H22N2S and molecular weight 250.15 g/mol. IUPAC: 1-tert-butyl-3-(4-propan-2-ylphenyl)thiourea.
Chemical Property Profile of 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea
Property Insights of 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea
The XLogP value of 3.6 indicates that 1-Tert-butyl-3-(4-propan-2-ylphenyl)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-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Tert-butyl-3-(4-propan-2-ylphenyl)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-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea?
The CAS number of 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea is 652965-51-0.
What is the molecular formula of 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea?
The molecular formula of 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea is C14H22N2S.
What is the molecular weight of 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea?
The molecular weight of 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea is 250.15 g/mol.
Where can I buy 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea?
You can request a quote for 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Tert-butyl-3-(4-propan-2-ylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.