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CAS 35973-17-2 8-BROMO-4-HYDROXYQUINOLINE-3-CARBOXYLIC ACID molecular structure lightbox
CAS RN: 35973-17-2

8-BROMO-4-HYDROXYQUINOLINE-3-CARBOXYLIC ACID

Product Availability

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250405 100mg In stock Inquiry
Batchno.20250615 1g In stock Inquiry
Batchno.20260306 250mg In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250428 100mg / 250mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS35973-17-2
  • Purity/Analytical Methods: >99.0%
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35973-17-2 / 8-bromo-4-oxo-1H-quinoline-3-carboxylic acid

Standard CAS: 35973-17-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
35973-17-2
Multi CAS
No
Molecular Formula
BC10H6O3Rn
Molecular Weight
268.060000
Exact Mass
266.953110
InChI
InChI=1S/C10H6BrNO3/c11-7-3-1-2-5-8(7)12-4-6(9(5)13)10(14)15/h1-4H,(H,12,13)(H,14,15)
InChIKey
NKUGXZLINWIUOR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
10
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
59.23
TPSA
70.16

LogP / Solubility

WLOGP
1.99
MLOGP
1.76
XLogP3
2.5
Consensus LogP
2.08
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.19
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.17
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.94

Drug-likeness / Medicinal Chemistry

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

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