CAS RN: 7672-76-6
alpha,alpha’-dimethylpiperazine-1,4-diethanol
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.20250716 | 5g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS7672-76-6
- Purity/Analytical Methods: >99.0%
7672-76-6 / 1-[4-(2-hydroxypropyl)piperazin-1-yl]propan-2-ol
Basic Information
CAS
7672-76-6
Multi CAS
Yes
Molecular Formula
C10H22N2O2
Molecular Weight
202.290000
Exact Mass
202.168128
InChI
InChI=1S/C10H22N2O2/c1-9(13)7-11-3-5-12(6-4-11)8-10(2)14/h9-10,13-14H,3-8H2,1-2H3
InChIKey
ZRMOLCPODIMNPJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
2
Molar refractivity
56.24
TPSA
46.94
LogP / Solubility
WLOGP
-0.63
MLOGP
-0.56
XLogP3
-0.4
Consensus LogP
-0.53
Log S (ESOL)
-0.43
Class (ESOL)
Very soluble
Log S (Ali)
-0.76
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.93
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
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)
-4.4
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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