CAS RN: 4329-75-3

1,2-Bis(4-pyridylcarbonyl)hydrazine

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  • Product code: starshine_CAS4329-75-3
  • Purity/Analytical Methods: >99.0%
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4329-75-3 / N'-(pyridine-4-carbonyl)pyridine-4-carbohydrazide

Standard CAS: 4329-75-3 Multi CAS: Yes

Basic Information

CAS
4329-75-3
Multi CAS
Yes
Molecular Formula
C12H10N4O2
Molecular Weight
242.230000
Exact Mass
242.080376
InChI
InChI=1S/C12H10N4O2/c17-11(9-1-5-13-6-2-9)15-16-12(18)10-3-7-14-8-4-10/h1-8H,(H,15,17)(H,16,18)
InChIKey
HDADCMZPLLONGB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
63.41
TPSA
83.98

LogP / Solubility

WLOGP
0.55
MLOGP
0.49
XLogP3
0.2
Consensus LogP
0.41
Log S (ESOL)
-2.05
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.94
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.93
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)
-3.81

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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