1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea
TL;DR: 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea (CAS 1024572-85-7) is a chemical compound with molecular formula C15H11F6N3S and molecular weight 379.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,5-bis(trifluoromethyl)phenyl]-3-(pyridin-2-ylmethyl)thiourea
Also Known As: 1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-(2-PYRIDYLMETHYL)THIOUREA, 1-[3,5-bis(trifluoromethyl)phenyl]-3-(pyridin-2-ylmethyl)thiourea, 3-[3,5-bis(trifluoromethyl)phenyl]-1-[(pyridin-2-yl)methyl]thiourea, 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(pyridin-2-ylmethyl)thiourea, 1-[3,5-bis(trifluoromethyl)phenyl]-3-(2-pyridylmethyl)thiourea
| Molecular Formula | C15H11F6N3S |
|---|---|
| Molecular Weight | 379.06 g/mol |
| LogP | 4.6058 |
| Topological Polar Surface Area | 36.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.0578 |
| Heavy Atoms | 25 |
| Complexity | 710.9173 |
Chemical Identifiers
| CAS Number | 1024572-85-7 |
|---|---|
| SMILES | C1=CC=NC(=C1)CNC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F |
Product Overview
1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea (CAS 1024572-85-7), with molecular formula C15H11F6N3S and molecular weight 379.06 g/mol. IUPAC: 1-[3,5-bis(trifluoromethyl)phenyl]-3-(pyridin-2-ylmethyl)thiourea.
Chemical Property Profile of 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea
Property Insights of 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea
The XLogP value of 4.6058 indicates that 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.95 Ų, 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea has 2 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-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea?
The CAS number of 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea is 1024572-85-7.
What is the molecular formula of 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea?
The molecular formula of 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea is C15H11F6N3S.
What is the molecular weight of 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea?
The molecular weight of 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea is 379.06 g/mol.
Where can I buy 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea?
You can request a quote for 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-Bis(trifluoromethyl)phenyl)-3-(2-pyridylmethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.