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CAS 73268-15-2 4-Methylpyridazine-3,6-dione molecular structure lightbox
CAS RN: 73268-15-2

4-Methylpyridazine-3,6-dione

  • Product code: SSC-182732
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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: 0.25g
  • Available purity: ≥95%
  • 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 73268-15-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry

73268-15-2 / 4-methylpyridazine-3,6-dione

Standard CAS: 73268-15-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
73268-15-2
Multi CAS
No
Molecular Formula
C5H4N2O2
Molecular Weight
124.100000
Exact Mass
124.027277
InChI
InChI=1S/C5H4N2O2/c1-3-2-4(8)6-7-5(3)9/h2H,1H3
InChIKey
KCFIRVDEKAERQV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.2
H-bond acceptors
2
Molar refractivity
28.63
TPSA
58.86

LogP / Solubility

WLOGP
0.45
MLOGP
0.39
XLogP3
0.5
Consensus LogP
0.45
Log S (ESOL)
-0.89
Class (ESOL)
Very soluble
Log S (Ali)
-0.9
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.84
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.16

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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