CAS RN: 401565-93-3
PIPERIDIN-4-YL-(4-TRIFLUOROMETHYL-PHENYL)-AMINE
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.20250912 | 250mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS401565-93-3
- Purity/Analytical Methods: >99.0%
401565-93-3 / N-[4-(trifluoromethyl)phenyl]piperidin-4-amine
Basic Information
CAS
401565-93-3
Multi CAS
No
Molecular Formula
C12F3H15N2
Molecular Weight
244.260000
Exact Mass
244.118733
InChI
InChI=1S/C12H15F3N2/c13-12(14,15)9-1-3-10(4-2-9)17-11-5-7-16-8-6-11/h1-4,11,16-17H,5-8H2
InChIKey
BYQLBAFAFQPRPU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
60.96
TPSA
24.06
LogP / Solubility
WLOGP
2.87
MLOGP
2.53
XLogP3
2.9
Consensus LogP
2.77
Log S (ESOL)
-3.29
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.63
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.87
Class (SILICOS-IT)
Poorly 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)
-2.17
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
1-Piperazinecarboxylic acid, 4-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)-, 1,1-diMethylethyl ester
- CAS RN: 401566-78-7
- Product Code: SSC-148164
-
-
(2S,4S)-4-[4-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)-1-piperazinyl]-2-(3-thiazolidinylcarbonyl)-1-pyrrolidinecarboxylic acid tert-butyl ester
- CAS RN: 401566-80-1
- Product Code: SSC-148166
-
1H-Benzimidazole-5-carbonitrile,2-chloro-(9CI)
- CAS RN: 401567-00-8
- Product Code: SSC-148167
-
-
2H-Benzimidazol-2-one,5-fluoro-1,3-dihydro-1-methyl-(9CI)
- CAS RN: 401567-11-1
- Product Code: SSC-148169
![CAS 401566-80-1 (2S,4S)-4-[4-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)-1-piperazinyl]-2-(3-thiazolidinylcarbonyl)-1-pyrrolidinecarboxylic acid tert-butyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/401566-80-1.gif)
