CAS RN: 885520-18-3
7-BROMO-1H-INDAZOLE-3-CARBOXYLIC ACID
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250416 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS885520-18-3
- Purity/Analytical Methods: >99.0%
885520-18-3 / 6-hydroxy-1H-indazole-3-carboxylic acid
Basic Information
CAS
885520-18-3
Multi CAS
Yes
Molecular Formula
C8H6N2O3
Molecular Weight
178.140000
Exact Mass
178.037842
InChI
InChI=1S/C8H6N2O3/c11-4-1-2-5-6(3-4)9-10-7(5)8(12)13/h1-3,11H,(H,9,10)(H,12,13)
InChIKey
QKUPXKXLJARJPC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
3
Molar refractivity
44.72
TPSA
86.21
LogP / Solubility
WLOGP
0.97
MLOGP
0.85
XLogP3
1.1
Consensus LogP
0.97
Log S (ESOL)
-2
Class (ESOL)
Soluble
Log S (Ali)
-1.72
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.74
Class (SILICOS-IT)
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)
-3.12
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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- CAS RN: 885520-22-9
- Product Code: starshine_CAS885520-22-9
- Purity/Analytical method: >99.0%
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