1-Benzyl-1-butyl-3-phenyl-2-thiourea
TL;DR: 1-Benzyl-1-butyl-3-phenyl-2-thiourea (CAS 101786-18-9) is a chemical compound with molecular formula C18H22N2S and molecular weight 298.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-1-butyl-3-phenylthiourea
Also Known As: 1-benzyl-1-butyl-3-phenyl-2-thiourea, 1-benzyl-1-butyl-3-phenylthiourea, 3-BENZYL-3-BUTYL-1-PHENYLTHIOUREA, 659-154-8, RefChem:429723
| Molecular Formula | C18H22N2S |
|---|---|
| Molecular Weight | 298.15 g/mol |
| LogP | 4.6857 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.15036 |
| Heavy Atoms | 21 |
| Complexity | 539.6595 |
Chemical Identifiers
| CAS Number | 101786-18-9 |
|---|---|
| SMILES | CCCCN(CC1=CC=CC=C1)C(=S)NC2=CC=CC=C2 |
Product Overview
1-Benzyl-1-butyl-3-phenyl-2-thiourea (CAS 101786-18-9), with molecular formula C18H22N2S and molecular weight 298.15 g/mol. IUPAC: 1-benzyl-1-butyl-3-phenylthiourea.
Chemical Property Profile of 1-Benzyl-1-butyl-3-phenyl-2-thiourea
Property Insights of 1-Benzyl-1-butyl-3-phenyl-2-thiourea
The XLogP value of 4.6857 indicates that 1-Benzyl-1-butyl-3-phenyl-2-thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.27 Ų, 1-Benzyl-1-butyl-3-phenyl-2-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-1-butyl-3-phenyl-2-thiourea has 1 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-Benzyl-1-butyl-3-phenyl-2-thiourea?
The CAS number of 1-Benzyl-1-butyl-3-phenyl-2-thiourea is 101786-18-9.
What is the molecular formula of 1-Benzyl-1-butyl-3-phenyl-2-thiourea?
The molecular formula of 1-Benzyl-1-butyl-3-phenyl-2-thiourea is C18H22N2S.
What is the molecular weight of 1-Benzyl-1-butyl-3-phenyl-2-thiourea?
The molecular weight of 1-Benzyl-1-butyl-3-phenyl-2-thiourea is 298.15 g/mol.
Where can I buy 1-Benzyl-1-butyl-3-phenyl-2-thiourea?
You can request a quote for 1-Benzyl-1-butyl-3-phenyl-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-Benzyl-1-butyl-3-phenyl-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-1-butyl-3-phenyl-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.