![CAS 338396-68-2 2-[4-(4-METHOXYPHENYL)PIPERAZINO]-1-PHENYL-1-ETHANONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB7318126(1).gif)
CAS RN: 338396-68-2
2-[4-(4-METHOXYPHENYL)PIPERAZINO]-1-PHENYL-1-ETHANONE
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.20250415 | 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS338396-68-2
- Purity/Analytical Methods: >99.0%
338396-68-2 / 2-[4-(4-methoxyphenyl)piperazin-1-yl]-1-phenylethanone
Basic Information
CAS
338396-68-2
Multi CAS
No
Molecular Formula
C19H22N2O2
Molecular Weight
310.400000
Exact Mass
310.168128
InChI
InChI=1S/C19H22N2O2/c1-23-18-9-7-17(8-10-18)21-13-11-20(12-14-21)15-19(22)16-5-3-2-4-6-16/h2-10H,11-15H2,1H3
InChIKey
USOKYESIBPHMER-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.32
Rotatable bonds
5
H-bond acceptors
4
Molar refractivity
92.42
TPSA
32.78
LogP / Solubility
WLOGP
2.7
MLOGP
2.39
XLogP3
3.2
Consensus LogP
2.76
Log S (ESOL)
-3.52
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.05
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.52
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.7
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
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