[email protected]
CAS 91086-21-4 Piperazine, 1-acetyl-4-propyl- (7CI) molecular structure lightbox
CAS RN: 91086-21-4

Piperazine, 1-acetyl-4-propyl- (7CI)

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260107 5g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS91086-21-4
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

91086-21-4 / 1-(4-propylpiperazin-1-yl)ethanone

Standard CAS: 91086-21-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
91086-21-4
Multi CAS
No
Molecular Formula
C9H18N2O
Molecular Weight
170.250000
Exact Mass
170.141913
InChI
InChI=1S/C9H18N2O/c1-3-4-10-5-7-11(8-6-10)9(2)12/h3-8H2,1-2H3
InChIKey
KOOLYPVFWPPNBC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.89
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
48.99
TPSA
23.55

LogP / Solubility

WLOGP
0.56
MLOGP
0.49
XLogP3
0.4
Consensus LogP
0.48
Log S (ESOL)
-1.12
Class (ESOL)
Soluble
Log S (Ali)
-1.36
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.47
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)
-3.36

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us