![CAS 606101-79-5 1H-Indeno[5,4-f]quinoline-7-carboxylic acid, 3-fluoro-2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-1,4a,6a-triMethyl-2-oxo-, (4aS,4bS,6aS,7S,9aS,9bS,11aR)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/606101-79-5.gif)
CAS RN: 606101-79-5
1H-Indeno[5,4-f]quinoline-7-carboxylic acid, 3-fluoro-2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-1,4a,6a-triMethyl-2-oxo-, (4aS,4bS,6aS,7S,9aS,9bS,11aR)-
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.20250516 | 10mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS606101-79-5
- Purity/Analytical Methods: >99.0%
606101-79-5 / 8-fluoro-6,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,5a,9b,10,11-decahydro-1H-indeno[5,4-f]quinoline-1-carboxylic acid
Basic Information
CAS
606101-79-5
Multi CAS
Yes
Molecular Formula
C20FH28NO3
Molecular Weight
349.400000
Exact Mass
349.205322
InChI
InChI=1S/C20H28FNO3/c1-19-9-8-13-11(12(19)5-6-14(19)18(24)25)4-7-16-20(13,2)10-15(21)17(23)22(16)3/h10-14,16H,4-9H2,1-3H3,(H,24,25)
InChIKey
ZXYFWGWIAUEVTK-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Fraction Csp3
0.8
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
91.26
TPSA
57.61
LogP / Solubility
WLOGP
3.62
MLOGP
3.21
XLogP3
4
Consensus LogP
3.61
Log S (ESOL)
-4.22
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.04
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.06
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.28
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
6.5
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![CAS 606101-78-4 1H-Indeno[5,4-f]quinoline-7-carboxylic acid, 3-fluoro-2,4a,4b,5,6,6a,7,8,9,9a,9b,10,11,11a-tetradecahydro-1,4a,6a-triMethyl-2-oxo-, Methyl ester, (4aS,4bS,6aS,7S,9aS,9bS,11aR)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/606101-78-4.gif)
