![CAS 76006-09-2 1,6-DIHYDRO-7H-PYRAZOLO[3,4-C]PYRIDIN-7-ONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/76006-09-2.gif)
CAS RN: 76006-09-2
1,6-DIHYDRO-7H-PYRAZOLO[3,4-C]PYRIDIN-7-ONE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260409 | 100mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS76006-09-2
- Purity/Analytical Methods: >99.0%
76006-09-2 / 1,6-dihydropyrazolo[5,4-c]pyridin-7-one
Basic Information
CAS
76006-09-2
Multi CAS
No
Molecular Formula
C6H5N3O
Molecular Weight
135.120000
Exact Mass
135.043262
InChI
InChI=1S/C6H5N3O/c10-6-5-4(1-2-7-6)3-8-9-5/h1-3H,(H,7,10)(H,8,9)
InChIKey
RPXFCERITFUFCN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
2
H-bond donors
2
Molar refractivity
36.71
TPSA
61.54
LogP / Solubility
WLOGP
0.25
MLOGP
0.21
Consensus LogP
0.15
Log S (ESOL)
-1.5
Class (ESOL)
Soluble
Log S (Ali)
-0.85
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.75
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.37
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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