1-(4-Anilinophenyl)-3-cyclopentylthiourea
TL;DR: 1-(4-Anilinophenyl)-3-cyclopentylthiourea (CAS 516456-99-8) is a chemical compound with molecular formula C18H21N3S and molecular weight 311.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-anilinophenyl)-3-cyclopentylthiourea
Also Known As: 1-(4-anilinophenyl)-3-cyclopentylthiourea, 1-cyclopentyl-3-[4-(phenylamino)phenyl]thiourea, N-(4-ANILINOPHENYL)-N'-CYCLOPENTYLTHIOUREA, (cyclopentylamino){[4-(phenylamino)phenyl]amino}methane-1-thione
| Molecular Formula | C18H21N3S |
|---|---|
| Molecular Weight | 311.15 g/mol |
| LogP | 4.6592 |
| Topological Polar Surface Area | 36.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.14563 |
| Heavy Atoms | 22 |
| Complexity | 603.9892 |
Chemical Identifiers
| CAS Number | 516456-99-8 |
|---|---|
| SMILES | C1CCC(C1)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3 |
Product Overview
1-(4-Anilinophenyl)-3-cyclopentylthiourea (CAS 516456-99-8), with molecular formula C18H21N3S and molecular weight 311.15 g/mol. IUPAC: 1-(4-anilinophenyl)-3-cyclopentylthiourea.
Chemical Property Profile of 1-(4-Anilinophenyl)-3-cyclopentylthiourea
Property Insights of 1-(4-Anilinophenyl)-3-cyclopentylthiourea
The XLogP value of 4.6592 indicates that 1-(4-Anilinophenyl)-3-cyclopentylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.09 Ų, 1-(4-Anilinophenyl)-3-cyclopentylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Anilinophenyl)-3-cyclopentylthiourea 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 1-(4-Anilinophenyl)-3-cyclopentylthiourea?
The CAS number of 1-(4-Anilinophenyl)-3-cyclopentylthiourea is 516456-99-8.
What is the molecular formula of 1-(4-Anilinophenyl)-3-cyclopentylthiourea?
The molecular formula of 1-(4-Anilinophenyl)-3-cyclopentylthiourea is C18H21N3S.
What is the molecular weight of 1-(4-Anilinophenyl)-3-cyclopentylthiourea?
The molecular weight of 1-(4-Anilinophenyl)-3-cyclopentylthiourea is 311.15 g/mol.
Where can I buy 1-(4-Anilinophenyl)-3-cyclopentylthiourea?
You can request a quote for 1-(4-Anilinophenyl)-3-cyclopentylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Anilinophenyl)-3-cyclopentylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Anilinophenyl)-3-cyclopentylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.