Pyrazole, 5-(3-indolyl)-3-(4-tolyl)-
TL;DR: Pyrazole, 5-(3-indolyl)-3-(4-tolyl)- (CAS 64640-77-3) is a chemical compound with molecular formula C18H15N3 and molecular weight 273.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1H-indole
Also Known As: Pyrazole, 5-(3-indolyl)-3-(4-tolyl)-, SD-066-4, 1H-Indole, 3-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-, 2,2'-Biquinoline,compd. with 2,4,6-trinitrophenol, 3-[3-(4-Methylphenyl)-1H-pyrazol-5-yl]-1H-indole #
| Molecular Formula | C18H15N3 |
|---|---|
| Molecular Weight | 273.13 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.1266 |
| Heavy Atoms | 21 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 64640-77-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NNC(=C2)C3=CNC4=CC=CC=C43 |
| InChIKey | XJUJNQLHZRQSNB-UHFFFAOYSA-N |
Product Overview
Pyrazole, 5-(3-indolyl)-3-(4-tolyl)- (CAS 64640-77-3), with molecular formula C18H15N3 and molecular weight 273.13 g/mol. IUPAC: 3-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1H-indole.
Chemical Property Profile of Pyrazole, 5-(3-indolyl)-3-(4-tolyl)-
Property Insights of Pyrazole, 5-(3-indolyl)-3-(4-tolyl)-
The XLogP value of 4.0 indicates that Pyrazole, 5-(3-indolyl)-3-(4-tolyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.5 Ų, Pyrazole, 5-(3-indolyl)-3-(4-tolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazole, 5-(3-indolyl)-3-(4-tolyl)- has 2 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 Pyrazole, 5-(3-indolyl)-3-(4-tolyl)-?
The CAS number of Pyrazole, 5-(3-indolyl)-3-(4-tolyl)- is 64640-77-3.
What is the molecular formula of Pyrazole, 5-(3-indolyl)-3-(4-tolyl)-?
The molecular formula of Pyrazole, 5-(3-indolyl)-3-(4-tolyl)- is C18H15N3.
What is the molecular weight of Pyrazole, 5-(3-indolyl)-3-(4-tolyl)-?
The molecular weight of Pyrazole, 5-(3-indolyl)-3-(4-tolyl)- is 273.13 g/mol.
Where can I buy Pyrazole, 5-(3-indolyl)-3-(4-tolyl)-?
You can request a quote for Pyrazole, 5-(3-indolyl)-3-(4-tolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazole, 5-(3-indolyl)-3-(4-tolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrazole, 5-(3-indolyl)-3-(4-tolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.