3,5-Dimethylpyrazolyl 4-phenylphenyl ketone
TL;DR: 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone (CAS 300804-24-4) is a chemical compound with molecular formula C18H16N2O and molecular weight 276.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-dimethylpyrazol-1-yl)-(4-phenylphenyl)methanone
Also Known As: TimTec1_005000, BAS 00315166, 3,5-dimethylpyrazolyl 4-phenylphenyl ketone, 1-(4-biphenylylcarbonyl)-3,5-dimethyl-1H-pyrazole, (3,5-dimethylpyrazol-1-yl)-(4-phenylphenyl)methanone
| Molecular Formula | C18H16N2O |
|---|---|
| Molecular Weight | 276.13 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.12625 |
| Heavy Atoms | 21 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 300804-24-4 |
|---|---|
| SMILES | CC1=CC(=NN1C(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C |
| InChIKey | GDGNTKCWCWLAPD-UHFFFAOYSA-N |
Product Overview
3,5-Dimethylpyrazolyl 4-phenylphenyl ketone (CAS 300804-24-4), with molecular formula C18H16N2O and molecular weight 276.13 g/mol. IUPAC: (3,5-dimethylpyrazol-1-yl)-(4-phenylphenyl)methanone.
Chemical Property Profile of 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone
Property Insights of 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone
The XLogP value of 4.2 indicates that 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.9 Ų, 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone 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 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone?
The CAS number of 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone is 300804-24-4.
What is the molecular formula of 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone?
The molecular formula of 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone is C18H16N2O.
What is the molecular weight of 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone?
The molecular weight of 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone is 276.13 g/mol.
Where can I buy 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone?
You can request a quote for 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethylpyrazolyl 4-phenylphenyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.