![1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea structure](/static/products/516/516456-86-3.png)
1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea
TL;DR: 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea (CAS 516456-86-3) is a chemical compound with molecular formula C17H21N3S and molecular weight 299.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-anilinophenyl)-3-(2-methylpropyl)thiourea
Also Known As: 1-(2-methylpropyl)-3-[4-(phenylamino)phenyl]thiourea, 1-(4-anilinophenyl)-3-(2-methylpropyl)thiourea, N-(4-ANILINOPHENYL)-N'-ISOBUTYLTHIOUREA, [(2-methylpropyl)amino]{[4-(phenylamino)phenyl]amino}methane-1-thione
| Molecular Formula | C17H21N3S |
|---|---|
| Molecular Weight | 299.15 g/mol |
| LogP | 4.3726 |
| Topological Polar Surface Area | 36.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.14563 |
| Heavy Atoms | 21 |
| Complexity | 564.34894 |
Chemical Identifiers
| CAS Number | 516456-86-3 |
|---|---|
| SMILES | CC(C)CNC(=S)NC1=CC=C(C=C1)NC2=CC=CC=C2 |
Product Overview
1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea (CAS 516456-86-3), with molecular formula C17H21N3S and molecular weight 299.15 g/mol. IUPAC: 1-(4-anilinophenyl)-3-(2-methylpropyl)thiourea.
Chemical Property Profile of 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea
Property Insights of 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea
The XLogP value of 4.3726 indicates that 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea 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-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea 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-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea?
The CAS number of 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea is 516456-86-3.
What is the molecular formula of 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea?
The molecular formula of 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea is C17H21N3S.
What is the molecular weight of 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea?
The molecular weight of 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea is 299.15 g/mol.
Where can I buy 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea?
You can request a quote for 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Methylpropyl)-3-[4-(phenylamino)phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.