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CAS 369626-03-9 1-Piperazinepropanol,-alpha-,-alpha–dimethyl-(9CI) molecular structure lightbox
CAS RN: 369626-03-9

1-Piperazinepropanol,-alpha-,-alpha–dimethyl-(9CI)

Product Availability

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5 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260418 100mg Out of stock Inquiry
Batchno.20251029 1g Out of stock Inquiry
Batchno.20250211 250mg Out of stock Inquiry
Batchno.20250225 50mg In stock Shenzhen Inquiry
Batchno.20260409 50mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS369626-03-9
  • Purity/Analytical Methods: >99.0%
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369626-03-9 / 2-methyl-4-piperazin-1-ylbutan-2-ol

Standard CAS: 369626-03-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
369626-03-9
Multi CAS
No
Molecular Formula
C9H20N2O
Molecular Weight
172.270000
Exact Mass
172.157563
InChI
InChI=1S/C9H20N2O/c1-9(2,12)3-6-11-7-4-10-5-8-11/h10,12H,3-8H2,1-2H3
InChIKey
YBASWHAGJKHKTN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
50.22
TPSA
35.5

LogP / Solubility

WLOGP
0.05
MLOGP
0.04
XLogP3
-0.1
Consensus LogP
0.0000
Log S (ESOL)
-0.74
Class (ESOL)
Very soluble
Log S (Ali)
-1.01
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.18
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)
-3.73

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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