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CAS 24573-15-7 4,4′-Bipyridine 1,1′-Dioxide molecular structure lightbox
CAS RN: 24573-15-7

4,4′-Bipyridine 1,1′-Dioxide

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260523 250mg / 1g / 5g / 25g Confirm by inquiry Shanghai, Shandong, Guangdong Inquiry
  • Product code: ICTB6159
  • Purity/Analytical Methods: >98.0%(T)(HPLC)
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24573-15-7 / 4-(1-oxido-4-pyridinylidene)pyridin-1-ium 1-oxide

Standard CAS: 24573-15-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
24573-15-7
Multi CAS
No
Molecular Formula
C10H8N2O2
Molecular Weight
188.180000
Exact Mass
188.058578
SMILES
C1=CN(C=CC1=C2C=C[N+](=O)C=C2)[O-]
InChI
InChI=1S/C10H8N2O2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H
InChIKey
CEJJXIXKGPQQNG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
H-bond acceptors
3
Molar refractivity
52.42
TPSA
46.38

LogP / Solubility

WLOGP
1.94
MLOGP
1.71
XLogP3
-0.3
Consensus LogP
1.12
Log S (ESOL)
-2.23
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.51
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.5
Class (SILICOS-IT)
Moderately 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)
-2.49

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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