CAS RN: 35973-25-2

4-Hydroxy-8-(hydroxy(oxido)amino)-3-quinolinecarboxylic acid

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6 package records5 with current stock2 grade groups
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Batchno.20260109 100mg In stock Shanghai Inquiry
Batchno.20250929 1g In stock Shanghai Inquiry
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  • Product code: starshine_CAS35973-25-2
  • Purity/Analytical Methods: >99.0%
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35973-25-2 / 8-nitro-4-oxo-1H-quinoline-3-carboxylic acid

Standard CAS: 35973-25-2 Multi CAS: Yes

Basic Information

CAS
35973-25-2
Multi CAS
Yes
Molecular Formula
C10H6N2O5
Molecular Weight
234.160000
Exact Mass
234.027671
InChI
InChI=1S/C10H6N2O5/c13-9-5-2-1-3-7(12(16)17)8(5)11-4-6(9)10(14)15/h1-4H,(H,11,13)(H,14,15)
InChIKey
BMIZBCVEHSUUNO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
10
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
58.18
TPSA
113.3

LogP / Solubility

WLOGP
1.13
MLOGP
1
XLogP3
1.7
Consensus LogP
1.28
Log S (ESOL)
-2.31
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.3
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.36
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
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)
-3.34

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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