[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone
TL;DR: [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone (CAS 438217-41-5) is a chemical compound with molecular formula C16H14F3N3O2 and molecular weight 337.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone
Also Known As: [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone, [5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl][4-(1H-pyrrol-1-yl)phenyl]methanone, 5-hydroxy-3-methyl-5-(trifluoromethyl)(2-pyrazolinyl) 4-pyrrolylphenyl ketone
| Molecular Formula | C16H14F3N3O2 |
|---|---|
| Molecular Weight | 337.10 g/mol |
| LogP | 2.95 |
| Topological Polar Surface Area | 57.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.10382 |
| Heavy Atoms | 24 |
| Complexity | 781.899 |
Chemical Identifiers
| CAS Number | 438217-41-5 |
|---|---|
| SMILES | CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)N3C=CC=C3 |
Product Overview
[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone (CAS 438217-41-5), with molecular formula C16H14F3N3O2 and molecular weight 337.10 g/mol. IUPAC: [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone.
Chemical Property Profile of [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone
Property Insights of [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone
The XLogP value of 2.95 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone. With a topological polar surface area (TPSA) of 57.83 Ų, [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone has 1 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 [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone?
The CAS number of [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone is 438217-41-5.
What is the molecular formula of [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone?
The molecular formula of [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone is C16H14F3N3O2.
What is the molecular weight of [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone?
The molecular weight of [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone is 337.10 g/mol.
Where can I buy [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone?
You can request a quote for [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyrrol-1-ylphenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.