1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline
TL;DR: 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline (CAS 87885-63-0) is a chemical compound with molecular formula C15H20N2O2 and molecular weight 260.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(5R)-5-hydroxy-3,4,4,5-tetramethylpyrazol-1-yl]-(4-methylphenyl)methanone
Also Known As: J1.899.506I, 1-(p-methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline, 1-(4-Methylbenzoyl)-3,4,4,5-tetramethyl-2-pyrazoline-5beta-ol, 3,4,4,5-tetramethyl-1-(4-methylbenzoyl)-4,5-dihydro-1H-pyrazol-5-ol, (5-Hydroxy-3,4,4,5-tetramethyl-4,5-dihydro-1H-pyrazol-1-yl)(4-methylphenyl)methanone
| Molecular Formula | C15H20N2O2 |
|---|---|
| Molecular Weight | 260.15 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 260.15247 |
| Heavy Atoms | 19 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 87885-63-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N2[C@](C(C(=N2)C)(C)C)(C)O |
| InChIKey | YXIBPSMKHVALOY-OAHLLOKOSA-N |
Product Overview
1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline (CAS 87885-63-0), with molecular formula C15H20N2O2 and molecular weight 260.15 g/mol. IUPAC: [(5R)-5-hydroxy-3,4,4,5-tetramethylpyrazol-1-yl]-(4-methylphenyl)methanone.
Chemical Property Profile of 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline
Property Insights of 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline. With a topological polar surface area (TPSA) of 52.9 Ų, 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline 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 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline?
The CAS number of 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline is 87885-63-0.
What is the molecular formula of 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline?
The molecular formula of 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline is C15H20N2O2.
What is the molecular weight of 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline?
The molecular weight of 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline is 260.15 g/mol.
Where can I buy 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline?
You can request a quote for 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline?
Yes, KEHONG BIO provides custom synthesis services for 1-(p-Methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.