CAS RN: 481038-74-8
(R)-tert-butyl 2,4-dibenzylpiperazine-1-carboxylate
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.20250612 | 250mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS481038-74-8
- Purity/Analytical Methods: >99.0%
481038-74-8 / tert-butyl 2,4-dibenzylpiperazine-1-carboxylate
Basic Information
CAS
481038-74-8
Multi CAS
Yes
Molecular Formula
C23H30N2O2
Molecular Weight
366.500000
Exact Mass
366.230728
InChI
InChI=1S/C23H30N2O2/c1-23(2,3)27-22(26)25-15-14-24(17-20-12-8-5-9-13-20)18-21(25)16-19-10-6-4-7-11-19/h4-13,21H,14-18H2,1-3H3/t21-/m1/s1
InChIKey
WEZYFYMYMKUAHY-OAQYLSRUSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
12
Fraction Csp3
0.43
Rotatable bonds
4
H-bond acceptors
3
Molar refractivity
108.59
TPSA
32.78
LogP / Solubility
WLOGP
4.35
MLOGP
3.85
XLogP3
4.4
Consensus LogP
4.2
Log S (ESOL)
-4.92
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.71
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.13
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.87
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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