1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans-
TL;DR: 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans- (CAS 72129-83-0) is a chemical compound with molecular formula C18H18N2O and molecular weight 278.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3S,4R)-4-methyl-3,5-diphenyl-3,4-dihydropyrazol-2-yl]ethanone
Also Known As: 5-23-09-00073 (Beilstein Handbook Reference), 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans-, trans-1-Acetyl-3,5-diphenyl-4-methyl-4,5-dihydropyrazole, 1-[(3S,4R)-4-methyl-3,5-diphenyl-3,4-dihydropyrazol-2-yl]ethanone, 1-[(4R,5S)-4-Methyl-3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
| Molecular Formula | C18H18N2O |
|---|---|
| Molecular Weight | 278.14 g/mol |
| LogP | 3.6302 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.1419 |
| Heavy Atoms | 21 |
| Complexity | 664.1324 |
Chemical Identifiers
| CAS Number | 72129-83-0 |
|---|---|
| SMILES | C[C@@H]1[C@H](N(N=C1C2=CC=CC=C2)C(=O)C)C3=CC=CC=C3 |
Product Overview
1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans- (CAS 72129-83-0), with molecular formula C18H18N2O and molecular weight 278.14 g/mol. IUPAC: 1-[(3S,4R)-4-methyl-3,5-diphenyl-3,4-dihydropyrazol-2-yl]ethanone.
Chemical Property Profile of 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans-
Property Insights of 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans-
The XLogP value of 3.6302 indicates that 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.67 Ų, 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans- has 0 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 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans-?
The CAS number of 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans- is 72129-83-0.
What is the molecular formula of 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans-?
The molecular formula of 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans- is C18H18N2O.
What is the molecular weight of 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans-?
The molecular weight of 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans- is 278.14 g/mol.
Where can I buy 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans-?
You can request a quote for 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole, 4,5-dihydro-1-acetyl-3,5-diphenyl-4-methyl-, trans- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.