CAS RN: 93343-02-3
4-Piperidinol, 1-(trifluoroacetyl)- (9CI)
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.20250805 | 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS93343-02-3
- Purity/Analytical Methods: >99.0%
93343-02-3 / 2,2,2-trifluoro-1-(4-hydroxypiperidin-1-yl)ethanone
Basic Information
CAS
93343-02-3
Multi CAS
No
Molecular Formula
C7F3H10NO2
Molecular Weight
197.150000
Exact Mass
197.066363
InChI
InChI=1S/C7H10F3NO2/c8-7(9,10)6(13)11-3-1-5(12)2-4-11/h5,12H,1-4H2
InChIKey
KTDQXDGUSKGKAP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
0.86
H-bond acceptors
2
H-bond donors
1
Molar refractivity
37.88
TPSA
40.54
LogP / Solubility
WLOGP
0.53
MLOGP
0.47
XLogP3
0.7
Consensus LogP
0.57
Log S (ESOL)
-1.4
Class (ESOL)
Soluble
Log S (Ali)
-1.56
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.38
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)
-3.54
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
