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CAS 5372-23-6 5-Cyano-1H-imidazole-4-carboxamide molecular structure lightbox
CAS RN: 5372-23-6

5-Cyano-1H-imidazole-4-carboxamide

  • Product code: SSC-161121
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 5372-23-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

5372-23-6 / 4-cyano-1H-imidazole-5-carboxamide

Standard CAS: 5372-23-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5372-23-6
Multi CAS
Yes
Molecular Formula
C5H4N4O
Molecular Weight
136.110000
Exact Mass
136.038511
InChI
InChI=1S/C5H4N4O/c6-1-3-4(5(7)10)9-2-8-3/h2H,(H2,7,10)(H,8,9)
InChIKey
QBKYWNHLILCGEI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
31.82
TPSA
95.56

LogP / Solubility

WLOGP
-0.62
MLOGP
-0.55
XLogP3
-0.7
Consensus LogP
-0.62
Log S (ESOL)
-0.6
Class (ESOL)
Very soluble
Log S (Ali)
-0.23
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.15
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)
-3.99

Drug-likeness / Medicinal Chemistry

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

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