![CAS 486443-73-6 (3Z)-5-bromo-3-[(3-bromo-4,5-dihydroxyphenyl)methylidene]-1H-indol-2-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/486443-73-6.gif)
CAS RN: 486443-73-6
(3Z)-5-bromo-3-[(3-bromo-4,5-dihydroxyphenyl)methylidene]-1H-indol-2-one
Product Availability
Choose a grade to view its available package options.
7 package records7 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250530 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260315 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20260129 | 1mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry | |
| Batchno.20250211 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20251006 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20251102 | 5mg | In stock | Shanghai, Tianjin | Inquiry | |
| Batchno.20260525 | 5mg / 10mg / 100mg / 250mg | Confirm by inquiry | Shanghai | 8-10 business days | Inquiry |
- Product code: starshine_CAS486443-73-6
- Purity/Analytical Methods: >99.0%
486443-73-6 / (3Z)-5-bromo-3-[(3-bromo-4,5-dihydroxyphenyl)methylidene]-1H-indol-2-one
Basic Information
CAS
486443-73-6
Multi CAS
Yes
Molecular Formula
C15H9BR2NO3
Molecular Weight
411.040000
Exact Mass
410.892870
InChI
InChI=1S/C15H9Br2NO3/c16-8-1-2-12-9(6-8)10(15(21)18-12)3-7-4-11(17)14(20)13(19)5-7/h1-6,19-20H,(H,18,21)/b10-3-
InChIKey
GPKLWRHHVIBYEO-KMKOMSMNSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
3
Molar refractivity
88.11
TPSA
69.56
LogP / Solubility
WLOGP
4.12
MLOGP
3.65
XLogP3
3.6
Consensus LogP
3.79
Log S (ESOL)
-5.34
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.9
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.87
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.31
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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