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CAS 73027-78-8 4-broMo-6-hydroxypyridine-3-carboxylic acid molecular structure lightbox
CAS RN: 73027-78-8

4-broMo-6-hydroxypyridine-3-carboxylic acid

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260131 50mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS73027-78-8
  • Purity/Analytical Methods: >99.0%
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73027-78-8 / 4-bromo-6-oxo-1H-pyridine-3-carboxylic acid

Standard CAS: 73027-78-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
73027-78-8
Multi CAS
No
Molecular Formula
BC6H4O3Rn
Molecular Weight
218.000000
Exact Mass
216.937460
InChI
InChI=1S/C6H4BrNO3/c7-4-1-5(9)8-2-3(4)6(10)11/h1-2H,(H,8,9)(H,10,11)
InChIKey
LOXKNBSOLALQFL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
41.72
TPSA
70.16

LogP / Solubility

WLOGP
0.84
MLOGP
0.74
XLogP3
-0.1
Consensus LogP
0.49
Log S (ESOL)
-2.06
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.95
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.89
Class (SILICOS-IT)
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)
-3.46

Drug-likeness / Medicinal Chemistry

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

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