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CAS 56563-00-9 2-(1H-imidazol-1-yl)acetohydrazide(SALTDATA: HCl) molecular structure lightbox
CAS RN: 56563-00-9

2-(1H-imidazol-1-yl)acetohydrazide(SALTDATA: HCl)

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251116 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS56563-00-9
  • Purity/Analytical Methods: >99.0%
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56563-00-9 / 2-imidazol-1-ylacetohydrazide

Standard CAS: 56563-00-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
56563-00-9
Multi CAS
Yes
Molecular Formula
C5H8N4O
Molecular Weight
140.140000
Exact Mass
140.069811
InChI
InChI=1S/C5H8N4O/c6-8-5(10)3-9-2-1-7-4-9/h1-2,4H,3,6H2,(H,8,10)
InChIKey
CNCNYKXWAPNJEP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.2
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
34.56
TPSA
72.94

LogP / Solubility

WLOGP
-1.13
MLOGP
-1
XLogP3
-1.3
Consensus LogP
-1.14
Log S (ESOL)
-0.24
Class (ESOL)
Very soluble
Log S (Ali)
0.1
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.12
Class (SILICOS-IT)
Highly 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)
-4.38

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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