1-Heptyl-3-phenyl-2-thiourea
TL;DR: 1-Heptyl-3-phenyl-2-thiourea (CAS 79425-04-0) 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-heptyl-3-phenylthiourea
Also Known As: 1-Heptyl-3-phenyl-2-thiourea, 1-heptyl-3-phenylthiourea, N-heptyl-N'-phenylthiourea, 1-heptyl-3-phenyl-thiourea, 2,5-Dichlorobenzimidazole
| Molecular Formula | C14H22N2S |
|---|---|
| Molecular Weight | 250.15 g/mol |
| LogP | 3.9434 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 250.15038 |
| Heavy Atoms | 17 |
| Complexity | 311.25806 |
Chemical Identifiers
| CAS Number | 79425-04-0 |
|---|---|
| SMILES | CCCCCCCNC(=S)NC1=CC=CC=C1 |
Product Overview
1-Heptyl-3-phenyl-2-thiourea (CAS 79425-04-0), with molecular formula C14H22N2S and molecular weight 250.15 g/mol. IUPAC: 1-heptyl-3-phenylthiourea.
Chemical Property Profile of 1-Heptyl-3-phenyl-2-thiourea
Property Insights of 1-Heptyl-3-phenyl-2-thiourea
The XLogP value of 3.9434 indicates that 1-Heptyl-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 24.06 Ų, 1-Heptyl-3-phenyl-2-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Heptyl-3-phenyl-2-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-Heptyl-3-phenyl-2-thiourea?
The CAS number of 1-Heptyl-3-phenyl-2-thiourea is 79425-04-0.
What is the molecular formula of 1-Heptyl-3-phenyl-2-thiourea?
The molecular formula of 1-Heptyl-3-phenyl-2-thiourea is C14H22N2S.
What is the molecular weight of 1-Heptyl-3-phenyl-2-thiourea?
The molecular weight of 1-Heptyl-3-phenyl-2-thiourea is 250.15 g/mol.
Where can I buy 1-Heptyl-3-phenyl-2-thiourea?
You can request a quote for 1-Heptyl-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-Heptyl-3-phenyl-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Heptyl-3-phenyl-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.