![CAS 1425511-32-5 3(2H)-Pyridazinone, 4-hydroxy-6-[2-[4-(trifluoromethyl)phenyl]ethyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1425511-32-5.gif)
CAS RN: 1425511-32-5
3(2H)-Pyridazinone, 4-hydroxy-6-[2-[4-(trifluoromethyl)phenyl]ethyl]-
Product Availability
Choose a grade to view its available package options.
7 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260304 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250204 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20260203 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250617 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250629 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20260417 | 5mg | Out of stock | 15 business days | Inquiry | |
| Batchno.20250524 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1425511-32-5
- Purity/Analytical Methods: >99.0%
1425511-32-5 / 6-[2-[4-(trifluoromethyl)phenyl]ethyl]-1,2-dihydropyridazine-3,4-dione
Basic Information
CAS
1425511-32-5
Multi CAS
No
Molecular Formula
C13H11F3N2O2
Molecular Weight
284.230000
Exact Mass
284.077262
SMILES
C1=CC(=CC=C1CCC2=CC(=O)C(=O)NN2)C(F)(F)F
InChI
InChI=1S/C13H11F3N2O2/c14-13(15,16)9-4-1-8(2-5-9)3-6-10-7-11(19)12(20)18-17-10/h1-2,4-5,7H,3,6H2,(H,17,19)(H,18,20)
InChIKey
QBQMUMMSYHUDFM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.23
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
66.54
TPSA
65.72
LogP / Solubility
WLOGP
1.87
MLOGP
1.65
XLogP3
2.7
Consensus LogP
2.07
Log S (ESOL)
-3.02
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.24
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.42
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.13
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
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![CAS 1425933-51-2 4-Amino-2-chloro-5-[(trimethylsilyl)ethynyl]benzonitrile molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1425933-51-2.gif)
