CAS RN: 771528-85-9
3-AMINO-3-PYRIDIN-2-YL-PROPIONIC ACID AMIDE
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.20250520 | 50mg / 100mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS771528-85-9
- Purity/Analytical Methods: >99.0%
771528-85-9 / 3-amino-3-pyridin-2-ylpropanamide
Basic Information
CAS
771528-85-9
Multi CAS
No
Molecular Formula
C8H11N3O
Molecular Weight
165.190000
Exact Mass
165.090212
InChI
InChI=1S/C8H11N3O/c9-6(5-8(10)12)7-3-1-2-4-11-7/h1-4,6H,5,9H2,(H2,10,12)
InChIKey
ZBRSERNJFMAHFZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
44.98
TPSA
82
LogP / Solubility
WLOGP
-0.04
MLOGP
-0.04
XLogP3
-1.4
Consensus LogP
-0.49
Log S (ESOL)
-1.01
Class (ESOL)
Soluble
Log S (Ali)
-0.88
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.06
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.76
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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