CAS RN: 6483-50-7
1,4-DIETHYLPIPERAZINE
Product Availability
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4 package records4 with current stock1 grade group
- Product code: starshine_CAS6483-50-7
- Purity/Analytical Methods: >99.0%
6483-50-7 / 1,4-diethylpiperazine
Basic Information
CAS
6483-50-7
Multi CAS
Yes
Molecular Formula
C8H18N2
Molecular Weight
142.240000
Exact Mass
142.146999
InChI
InChI=1S/C8H18N2/c1-3-9-5-7-10(4-2)8-6-9/h3-8H2,1-2H3
InChIKey
DDPRYTUJYNYJKV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
44.23
TPSA
6.48
LogP / Solubility
WLOGP
0.64
MLOGP
0.56
XLogP3
0.8
Consensus LogP
0.67
Log S (ESOL)
-1
Class (ESOL)
Very soluble
Log S (Ali)
-1.19
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.36
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)
-3.13
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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