CAS RN: 82502-77-0
1-(1-HEPTYL)-PIPERAZINE
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.20260207 | 10g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS82502-77-0
- Purity/Analytical Methods: >99.0%
82502-77-0 / 1-heptylpiperazine
Basic Information
CAS
82502-77-0
Multi CAS
No
Molecular Formula
C11H24N2
Molecular Weight
184.320000
Exact Mass
184.193949
InChI
InChI=1S/C11H24N2/c1-2-3-4-5-6-9-13-10-7-12-8-11-13/h12H,2-11H2,1H3
InChIKey
GFFSNSPNXPELQE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
1
Rotatable bonds
6
H-bond acceptors
2
H-bond donors
1
Molar refractivity
58.07
TPSA
15.27
LogP / Solubility
WLOGP
1.86
MLOGP
1.64
XLogP3
2.5
Consensus LogP
2
Log S (ESOL)
-1.76
Class (ESOL)
Soluble
Log S (Ali)
-2.42
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.12
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)
-2.52
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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