![CAS 61364-20-3 3,4-dihydro-Cyclopent[b]indol-1(2H)-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/61364-20-3.gif)
CAS RN: 61364-20-3
3,4-dihydro-Cyclopent[b]indol-1(2H)-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.20250821 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS61364-20-3
- Purity/Analytical Methods: >99.0%
61364-20-3 / 3,4-dihydro-2H-cyclopenta[b]indol-1-one
Basic Information
CAS
61364-20-3
Multi CAS
No
Molecular Formula
C11H9NO
Molecular Weight
171.190000
Exact Mass
171.068414
InChI
InChI=1S/C11H9NO/c13-10-6-5-9-11(10)7-3-1-2-4-8(7)12-9/h1-4,12H,5-6H2
InChIKey
IYZRSIDATZDOPT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
9
Fraction Csp3
0.18
H-bond acceptors
1
H-bond donors
1
Molar refractivity
50.95
TPSA
32.86
LogP / Solubility
WLOGP
2.3
MLOGP
2.02
XLogP3
1.8
Consensus LogP
2.04
Log S (ESOL)
-2.86
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.62
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.68
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)
-2.13
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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