![CAS 17326-09-9 4H-Pyrido[1,2-a]pyriMidin-4-one,2-hydroxy-9-Methyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/17326-09-9.gif)
CAS RN: 17326-09-9
4H-Pyrido[1,2-a]pyriMidin-4-one,2-hydroxy-9-Methyl-
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.20250308 | 100mg / 250mg / 1g / 5g / 10g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS17326-09-9
- Purity/Analytical Methods: >99.0%
17326-09-9 / 2-hydroxy-9-methylpyrido[1,2-a]pyrimidin-4-one
Basic Information
CAS
17326-09-9
Multi CAS
No
Molecular Formula
C9H8N2O2
Molecular Weight
176.170000
Exact Mass
176.058578
SMILES
CC1=CC=CN2C1=NC(=CC2=O)O
InChI
InChI=1S/C9H8N2O2/c1-6-3-2-4-11-8(13)5-7(12)10-9(6)11/h2-5,12H,1H3
InChIKey
KZDHTEHBHTWMIC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
10
Fraction Csp3
0.11
H-bond acceptors
4
H-bond donors
1
Molar refractivity
47.86
TPSA
54.6
LogP / Solubility
WLOGP
0.71
MLOGP
0.62
XLogP3
0.4
Consensus LogP
0.58
Log S (ESOL)
-1.95
Class (ESOL)
Soluble
Log S (Ali)
-1.52
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.39
Class (SILICOS-IT)
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)
-3.29
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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