![1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone structure](/static/products/7385/738593-17-4.webp)
1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone
TL;DR: 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone (CAS 738593-17-4) is a chemical compound with molecular formula C14H14F2N6O2 and molecular weight 336.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone
Also Known As: 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone, 1-[5-(DIFLUOROMETHYL)-5-HYDROXY-3-METHYL-4,5-DIHYDRO-1H-PYRAZOL-1-YL]-2-[4-(1H-1,2,3,4-TETRAAZOL-1-YL)PHENYL]-1-ETHANONE, 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl]-2-[4-(1H-tetrazol-1-yl)phenyl]ethanone
| Molecular Formula | C14H14F2N6O2 |
|---|---|
| Molecular Weight | 336.11 g/mol |
| LogP | 0.7667 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.11462 |
| Heavy Atoms | 24 |
| Complexity | 762.08167 |
Chemical Identifiers
| CAS Number | 738593-17-4 |
|---|---|
| SMILES | CC1=NN(C(C1)(C(F)F)O)C(=O)CC2=CC=C(C=C2)N3C=NN=N3 |
Product Overview
1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone (CAS 738593-17-4), with molecular formula C14H14F2N6O2 and molecular weight 336.11 g/mol. IUPAC: 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone.
Chemical Property Profile of 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone
Property Insights of 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone
The XLogP value of 0.7667 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone. Following Lipinski's Rule of Five, 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone has 1 hydrogen bond donor(s) and 6 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-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone?
The CAS number of 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone is 738593-17-4.
What is the molecular formula of 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone?
The molecular formula of 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone is C14H14F2N6O2.
What is the molecular weight of 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone?
The molecular weight of 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone is 336.11 g/mol.
Where can I buy 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone?
You can request a quote for 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.