1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea
TL;DR: 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea (CAS 516457-25-3) is a chemical compound with molecular formula C18H17N3S2 and molecular weight 339.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea
Also Known As: VU0047642-1, 1-(4-anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea, 1-[4-(phenylamino)phenyl]-3-(thiophen-2-ylmethyl)thiourea, N-(4-ANILINOPHENYL)-N'-(2-THIENYLMETHYL)THIOUREA, {[4-(phenylamino)phenyl]amino}[(2-thienylmethyl)amino]methane-1-thione
| Molecular Formula | C18H17N3S2 |
|---|---|
| Molecular Weight | 339.09 g/mol |
| LogP | 4.9783 |
| Topological Polar Surface Area | 36.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.0864 |
| Heavy Atoms | 23 |
| Complexity | 737.70746 |
Chemical Identifiers
| CAS Number | 516457-25-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NCC3=CC=CS3 |
Product Overview
1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea (CAS 516457-25-3), with molecular formula C18H17N3S2 and molecular weight 339.09 g/mol. IUPAC: 1-(4-anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea.
Chemical Property Profile of 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea
Property Insights of 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea
The XLogP value of 4.9783 indicates that 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)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-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea has 3 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 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea?
The CAS number of 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea is 516457-25-3.
What is the molecular formula of 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea?
The molecular formula of 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea is C18H17N3S2.
What is the molecular weight of 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea?
The molecular weight of 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea is 339.09 g/mol.
Where can I buy 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea?
You can request a quote for 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea 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-(thiophen-2-ylmethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Anilinophenyl)-3-(thiophen-2-ylmethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.