CAS RN: 90271-86-6
5-Bromo-3-cyanoindole
Product Availability
Choose a grade to view its available package options.
8 package records8 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250228 | 100g | In stock | Shanghai, Tianjin, Chengdu | Inquiry | |
| Batchno.20250325 | 100mg | In stock | Shanghai, Shenzhen, Tianjin | Inquiry | |
| Batchno.20250520 | 10g | In stock | Shanghai, Shenzhen | Inquiry | |
| Batchno.20260514 | 1g | In stock | Shanghai, Tianjin | Inquiry | |
| Batchno.20260509 | 250mg | In stock | Shanghai, Tianjin | Inquiry | |
| Batchno.20250312 | 250mg / 1g / 5g / 25g / 100g | Confirm by inquiry | Shandong | 5-7 business days | Inquiry |
| Batchno.20260612 | 25g | In stock | Shanghai, Tianjin, Chengdu | Inquiry | |
| Batchno.20251202 | 5g | In stock | Shanghai, Tianjin | Inquiry |
- Product code: SSC-202742
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 5g, 10g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
90271-86-6 / 5-bromo-1H-indole-3-carbonitrile
Basic Information
CAS
90271-86-6
Multi CAS
Yes
Molecular Formula
BC9H5Rn2
Molecular Weight
221.050000
Exact Mass
219.963610
InChI
InChI=1S/C9H5BrN2/c10-7-1-2-9-8(3-7)6(4-11)5-12-9/h1-3,5,12H
InChIKey
ZPUQCVKBNRGSAP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
9
H-bond acceptors
1
H-bond donors
1
Molar refractivity
50.71
TPSA
39.58
LogP / Solubility
WLOGP
2.8
MLOGP
2.47
XLogP3
3
Consensus LogP
2.76
Log S (ESOL)
-3.53
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.4
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.42
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.08
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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