CAS RN: 128427-05-4
(S)-2-ETHYL-PIPERAZINE-2HCl
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.20250606 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS128427-05-4
- Purity/Analytical Methods: >99.0%
128427-05-4 / (2S)-2-ethylpiperazine;dihydrochloride
Basic Information
CAS
128427-05-4
Multi CAS
No
Molecular Formula
C6H16Cl2N2
Molecular Weight
187.110000
Exact Mass
186.069054
SMILES
CC[C@H]1CNCCN1.Cl.Cl
InChI
InChI=1S/C6H14N2.2ClH/c1-2-6-5-7-3-4-8-6;;/h6-8H,2-5H2,1H3;2*1H/t6-;;/m0../s1
InChIKey
VCKAKBROIJTVJI-ILKKLZGPSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
49.45
TPSA
24.06
LogP / Solubility
WLOGP
0.8
MLOGP
0.7
XLogP3
0.8
Consensus LogP
0.77
Log S (ESOL)
-1.44
Class (ESOL)
Soluble
Log S (Ali)
-1.67
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.66
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)
-3.29
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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