(2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone
TL;DR: (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone (CAS 328386-51-2) is a chemical compound with molecular formula C12H10F2N2O and molecular weight 236.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-difluorophenyl)-(3,5-dimethylpyrazol-1-yl)methanone
Also Known As: 1-(2,6-difluorobenzoyl)-3,5-dimethyl-1H-pyrazole, 2,6-difluorophenyl 3,5-dimethylpyrazolyl ketone, (2,6-difluorophenyl)-(3,5-dimethylpyrazol-1-yl)methanone, (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone, F3386-5717
| Molecular Formula | C12H10F2N2O |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.07613 |
| Heavy Atoms | 17 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 328386-51-2 |
|---|---|
| SMILES | CC1=CC(=NN1C(=O)C2=C(C=CC=C2F)F)C |
| InChIKey | DYNZIFXNSLSDSA-UHFFFAOYSA-N |
Product Overview
(2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone (CAS 328386-51-2), with molecular formula C12H10F2N2O and molecular weight 236.08 g/mol. IUPAC: (2,6-difluorophenyl)-(3,5-dimethylpyrazol-1-yl)methanone.
Chemical Property Profile of (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone
Property Insights of (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone. With a topological polar surface area (TPSA) of 34.9 Ų, (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone has 0 hydrogen bond donor(s) and 4 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 (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone?
The CAS number of (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone is 328386-51-2.
What is the molecular formula of (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone?
The molecular formula of (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone is C12H10F2N2O.
What is the molecular weight of (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone?
The molecular weight of (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone is 236.08 g/mol.
Where can I buy (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone?
You can request a quote for (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (2,6-difluorophenyl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.