![3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea structure](/static/products/848/848657-91-0.png)
3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea
TL;DR: 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea (CAS 848657-91-0) is a chemical compound with molecular formula C18H16F3N3O and molecular weight 347.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(1H-indol-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]urea
Also Known As: 1-[2-(1H-indol-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]urea, 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea
| Molecular Formula | C18H16F3N3O |
|---|---|
| Molecular Weight | 347.12 g/mol |
| LogP | 4.5509 |
| Topological Polar Surface Area | 56.92 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.12454 |
| Heavy Atoms | 25 |
| Complexity | 886.40375 |
Chemical Identifiers
| CAS Number | 848657-91-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCNC(=O)NC3=CC=CC(=C3)C(F)(F)F |
Product Overview
3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea (CAS 848657-91-0), with molecular formula C18H16F3N3O and molecular weight 347.12 g/mol. IUPAC: 1-[2-(1H-indol-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]urea.
Chemical Property Profile of 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea
Property Insights of 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea
The XLogP value of 4.5509 indicates that 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.92 Ų, 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea has 3 hydrogen bond donor(s) and 1 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-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea?
The CAS number of 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea is 848657-91-0.
What is the molecular formula of 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea?
The molecular formula of 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea is C18H16F3N3O.
What is the molecular weight of 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea?
The molecular weight of 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea is 347.12 g/mol.
Where can I buy 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea?
You can request a quote for 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(1H-indol-3-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.