![CAS 4651-91-6 2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/4651-91-6.png)
CAS RN: 4651-91-6
2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile
Product Availability
Choose a grade to view its available package options.
11 package records11 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250707 | 100g | In stock | Shanghai | Inquiry |
| Batchno.20260529 | 10g | In stock | Shanghai, Chengdu | Inquiry |
| Batchno.20260530 | 1g | In stock | Shanghai, Shenzhen, Chengdu | Inquiry |
| Batchno.20250210 | 1g / 5g / 10g / 25g | Confirm by inquiry | Shanghai, Shandong | Inquiry |
| Batchno.20260225 | 25g | In stock | Shanghai, Shenzhen, Wuhan, Chengdu | Inquiry |
| Batchno.20250309 | 5g | In stock | Shanghai, Shenzhen, Chengdu | Inquiry |
- Product code: SSC-153881
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 1g, 25g, 5g, 0.25g, 10g, 100g
- Available purity: ≥97%
- Inventory rows with stock: 5
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥97% | 5 In Stock | Shanghai | Inquiry |
| 25g | ≥97% | 4 In Stock | Beijing | Inquiry |
| 5g | ≥97% | 3 In Stock | Beijing | Inquiry |
| 0.25g | ≥97% | 2 In Stock | Hong Kong | Inquiry |
| 10g | ≥97% | 2 In Stock | Beijing | Inquiry |
| 100g | ≥97% | 0 Out of Stock | Shenzhen | Inquiry |
4651-91-6 / 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Basic Information
CAS
4651-91-6
Multi CAS
Yes
Molecular Formula
C9H10N2S
Molecular Weight
178.260000
Exact Mass
178.056470
InChI
InChI=1S/C9H10N2S/c10-5-7-6-3-1-2-4-8(6)12-9(7)11/h1-4,11H2
InChIKey
ADHVMGAFAKSNOM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
5
Fraction Csp3
0.44
H-bond acceptors
3
H-bond donors
1
Molar refractivity
50.09
TPSA
49.81
LogP / Solubility
WLOGP
2.08
MLOGP
1.83
XLogP3
2.8
Consensus LogP
2.24
Log S (ESOL)
-2.56
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.52
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.55
Class (SILICOS-IT)
Moderately 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)
-2.33
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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