CAS RN: 5327-31-1

Nicotinic acid, 2-amino-, hydrazide

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250105 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS5327-31-1
  • Purity/Analytical Methods: >99.0%
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5327-31-1 / 2-aminopyridine-3-carbohydrazide

Standard CAS: 5327-31-1 Multi CAS: Yes

Basic Information

CAS
5327-31-1
Multi CAS
Yes
Molecular Formula
C6H8N4O
Molecular Weight
152.150000
Exact Mass
152.069811
InChI
InChI=1S/C6H8N4O/c7-5-4(6(11)10-8)2-1-3-9-5/h1-3H,8H2,(H2,7,9)(H,10,11)
InChIKey
FPRGDDUFZBEHLK-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
0.5
Consensus LogP
-0.29
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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