CAS RN: 64189-08-8
3-Amino-4-pyridinecarboxylic acid hydrazide
Product Availability
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3 package records3 with current stock1 grade group
- Product code: starshine_CAS64189-08-8
- Purity/Analytical Methods: >99.0%
64189-08-8 / 3-aminopyridine-4-carbohydrazide
Basic Information
CAS
64189-08-8
Multi CAS
Yes
Molecular Formula
C6H8N4O
Molecular Weight
152.150000
Exact Mass
152.069811
InChI
InChI=1S/C6H8N4O/c7-5-3-9-2-1-4(5)6(11)10-8/h1-3H,7-8H2,(H,10,11)
InChIKey
YEFPNWUYEOCTIE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
3
Molar refractivity
40.3
TPSA
94.03
LogP / Solubility
WLOGP
-0.73
MLOGP
-0.65
XLogP3
-0.7
Consensus LogP
-0.69
Log S (ESOL)
-0.66
Class (ESOL)
Very soluble
Log S (Ali)
-0.28
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.16
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
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)
-4.17
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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