CAS RN: 885519-88-0
6-AMINO-4-IODO-1H-INDAZOLE
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.20260222 | 100mg | Out of stock | 1 business days | Inquiry |
- Product code: starshine_CAS885519-88-0
- Purity/Analytical Methods: >99.0%
885519-88-0 / 4-iodo-1H-indazol-6-amine
Basic Information
CAS
885519-88-0
Multi CAS
No
Molecular Formula
C7H6In3
Molecular Weight
259.050000
Exact Mass
258.960640
InChI
InChI=1S/C7H6IN3/c8-6-1-4(9)2-7-5(6)3-10-11-7/h1-3H,9H2,(H,10,11)
InChIKey
KVXCGVBQIKMZLY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
2
H-bond donors
2
Molar refractivity
53.22
TPSA
54.7
LogP / Solubility
WLOGP
1.75
MLOGP
1.55
XLogP3
1.5
Consensus LogP
1.6
Log S (ESOL)
-3.15
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.95
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.8
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.06
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
