CAS RN: 90001-64-2
1-BENZOTHIOPHENE-2-SULFONYL CHLORIDE
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250331 | 250mg | In stock | Shandong | Inquiry |
- Product code: SSC-202322
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: 1g
- Available purity: ≥95%
- 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.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
90001-64-2 / 1-benzothiophene-2-sulfonyl chloride
Basic Information
CAS
90001-64-2
Multi CAS
No
Molecular Formula
C8H5CLO2S2
Molecular Weight
232.700000
Exact Mass
231.941949
InChI
InChI=1S/C8H5ClO2S2/c9-13(10,11)8-5-6-3-1-2-4-7(6)12-8/h1-5H
InChIKey
FKIIVBOPAHICHQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
54.86
TPSA
34.14
LogP / Solubility
WLOGP
2.83
MLOGP
2.49
XLogP3
3.3
Consensus LogP
2.87
Log S (ESOL)
-3.51
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.51
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.64
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)
-2.13
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 90002-06-5 2-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]pyridine molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
2-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]pyridine
- CAS RN: 90002-06-5
- Product Code: SSC-202331
-
Ketone, chloromethyl 1,3,5-trimethylpyrazol-4-yl (7CI)
- CAS RN: 90002-88-3
- Product Code: SSC-202335
-
-
GLYCEROL PROPOXYLATE-B-ETHOXYLATE
- CAS RN: 9082-00-2
- Product Code: starshine_CAS9082-00-2
- Purity/Analytical method: >99.0%
-
-
![CAS 90002-06-5 2-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/90002-06-5.gif)
