3-(3-Nitrophenyl)-1,1-dipentylthiourea
TL;DR: 3-(3-Nitrophenyl)-1,1-dipentylthiourea (CAS 708234-62-2) is a chemical compound with molecular formula C17H27N3O2S and molecular weight 337.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-nitrophenyl)-1,1-dipentylthiourea
Also Known As: 3-(3-nitrophenyl)-1,1-dipentylthiourea, (dipentylamino)[(3-nitrophenyl)amino]methane-1-thione
| Molecular Formula | C17H27N3O2S |
|---|---|
| Molecular Weight | 337.18 g/mol |
| LogP | 4.974 |
| Topological Polar Surface Area | 58.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 337.1824 |
| Heavy Atoms | 23 |
| Complexity | 498.3668 |
Chemical Identifiers
| CAS Number | 708234-62-2 |
|---|---|
| SMILES | CCCCCN(CCCCC)C(=S)NC1=CC(=CC=C1)[N+](=O)[O-] |
Product Overview
3-(3-Nitrophenyl)-1,1-dipentylthiourea (CAS 708234-62-2), with molecular formula C17H27N3O2S and molecular weight 337.18 g/mol. IUPAC: 3-(3-nitrophenyl)-1,1-dipentylthiourea.
Chemical Property Profile of 3-(3-Nitrophenyl)-1,1-dipentylthiourea
Property Insights of 3-(3-Nitrophenyl)-1,1-dipentylthiourea
The XLogP value of 4.974 indicates that 3-(3-Nitrophenyl)-1,1-dipentylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.41 Ų, 3-(3-Nitrophenyl)-1,1-dipentylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Nitrophenyl)-1,1-dipentylthiourea has 1 hydrogen bond donor(s) and 3 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 3-(3-Nitrophenyl)-1,1-dipentylthiourea?
The CAS number of 3-(3-Nitrophenyl)-1,1-dipentylthiourea is 708234-62-2.
What is the molecular formula of 3-(3-Nitrophenyl)-1,1-dipentylthiourea?
The molecular formula of 3-(3-Nitrophenyl)-1,1-dipentylthiourea is C17H27N3O2S.
What is the molecular weight of 3-(3-Nitrophenyl)-1,1-dipentylthiourea?
The molecular weight of 3-(3-Nitrophenyl)-1,1-dipentylthiourea is 337.18 g/mol.
Where can I buy 3-(3-Nitrophenyl)-1,1-dipentylthiourea?
You can request a quote for 3-(3-Nitrophenyl)-1,1-dipentylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Nitrophenyl)-1,1-dipentylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Nitrophenyl)-1,1-dipentylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.