CAS RN: 4025-37-0

2-(AZIRIDIN-1-YL)ETHANAMINE

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Batchno.20250107 250mg Out of stock Inquiry
  • Product code: starshine_CAS4025-37-0
  • Purity/Analytical Methods: >99.0%
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4025-37-0 / 2-(aziridin-1-yl)ethanamine

Standard CAS: 4025-37-0 Multi CAS: Yes

Basic Information

CAS
4025-37-0
Multi CAS
Yes
Molecular Formula
C4H10N2
Molecular Weight
86.140000
Exact Mass
86.084398
InChI
InChI=1S/C4H10N2/c5-1-2-6-3-4-6/h1-5H2
InChIKey
LSDGFGPIFBOTJI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
25.49
TPSA
29.03

LogP / Solubility

WLOGP
-0.74
MLOGP
-0.66
XLogP3
-0.9
Consensus LogP
-0.77
Log S (ESOL)
0.22
Class (ESOL)
Highly soluble
Log S (Ali)
0.27
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.15
Class (SILICOS-IT)
Highly 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)
-3.77

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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