![CAS 147764-61-2 5H-IMidazo[5,1-a]isoindole molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/147764-61-2.gif)
CAS RN: 147764-61-2
5H-IMidazo[5,1-a]isoindole
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.20250304 | 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS147764-61-2
- Purity/Analytical Methods: >99.0%
147764-61-2 / 5H-imidazo[5,1-a]isoindole
Basic Information
CAS
147764-61-2
Multi CAS
No
Molecular Formula
C10H8N2
Molecular Weight
156.180000
Exact Mass
156.068748
SMILES
C1C2=CC=CC=C2C3=CN=CN31
InChI
InChI=1S/C10H8N2/c1-2-4-9-8(3-1)6-12-7-11-5-10(9)12/h1-5,7H,6H2
InChIKey
PNYPJSJTDDEXRR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
11
Fraction Csp3
0.1
H-bond acceptors
2
Molar refractivity
46.77
TPSA
17.82
LogP / Solubility
WLOGP
1.91
MLOGP
1.68
XLogP3
1.3
Consensus LogP
1.63
Log S (ESOL)
-2.69
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.22
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.26
Class (SILICOS-IT)
Moderately 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)
-2.32
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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