![CAS 637015-80-6 2-[4-(3,4-DICHLOROPHENYL)-1,3-THIAZOL-2-YL]ACETONITRILE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/637015-80-6.gif)
CAS RN: 637015-80-6
2-[4-(3,4-DICHLOROPHENYL)-1,3-THIAZOL-2-YL]ACETONITRILE
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.20260404 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-173456
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 | Shanghai | Inquiry |
637015-80-6 / 2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]acetonitrile
Basic Information
CAS
637015-80-6
Multi CAS
No
Molecular Formula
C11H6CL2N2S
Molecular Weight
269.100000
Exact Mass
267.962875
InChI
InChI=1S/C11H6Cl2N2S/c12-8-2-1-7(5-9(8)13)10-6-16-11(15-10)3-4-14/h1-2,5-6H,3H2
InChIKey
QUKXPETXDIENML-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
11
Fraction Csp3
0.09
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
66.89
TPSA
36.68
LogP / Solubility
WLOGP
4.18
MLOGP
3.69
XLogP3
3.6
Consensus LogP
3.82
Log S (ESOL)
-4.52
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.79
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.12
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.39
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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