CAS RN: 914203-53-5
5-(4,5-dihydro-1H-iMidazol-2-yl)pyridin-2-aMine
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20250612 | 100mg | Out of stock | Inquiry |
- Product code: starshine_CAS914203-53-5
- Purity/Analytical Methods: >99.0%
914203-53-5 / 5-(4,5-dihydro-1H-imidazol-2-yl)pyridin-2-amine
Basic Information
CAS
914203-53-5
Multi CAS
No
Molecular Formula
C8H10N4
Molecular Weight
162.190000
Exact Mass
162.090546
InChI
InChI=1S/C8H10N4/c9-7-2-1-6(5-12-7)8-10-3-4-11-8/h1-2,5H,3-4H2,(H2,9,12)(H,10,11)
InChIKey
OQNXJRHACUNVJJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
48.06
TPSA
63.3
LogP / Solubility
WLOGP
0.01
MLOGP
0.01
XLogP3
-0.5
Consensus LogP
-0.16
Log S (ESOL)
-1.16
Class (ESOL)
Soluble
Log S (Ali)
-0.9
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.85
Class (SILICOS-IT)
Very 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)
-3.7
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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