CAS RN: 1202769-68-3
2-(Thiazol-2-Yl)But-3-Yn-2-Ol(WXC01393)
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.20250208 | 100mg / 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: SSC-021130
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 |
1202769-68-3 / 2-(1,3-thiazol-2-yl)but-3-yn-2-ol
2-(thiazol-2-yl)but-3-yn-2-ol | 2-(1,3-thiazol-2-yl)but-3-yn-2-ol | MFCD29059354
Basic Information
CAS
1202769-68-3
Multi CAS
No
Molecular Formula
C7H7NOS
Molecular Weight
153.200000
Exact Mass
153.024835
SMILES
CC(C#C)(C1=NC=CS1)O
InChI
InChI=1S/C7H7NOS/c1-3-7(2,9)6-8-4-5-10-6/h1,4-5,9H,2H3
InChIKey
JJCFOOAPKUJAIV-UHFFFAOYSA-N
Synonyms
2-(thiazol-2-yl)but-3-yn-2-ol
2-(1,3-thiazol-2-yl)but-3-yn-2-ol
MFCD29059354
SCHEMBL1613093
2-thiazol-2-ylbut-3-yn-2-ol
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.29
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
40.52
TPSA
33.12
LogP / Solubility
WLOGP
0.98
MLOGP
0.86
XLogP3
0.6
Consensus LogP
0.81
Log S (ESOL)
-1.71
Class (ESOL)
Soluble
Log S (Ali)
-1.53
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.59
Class (SILICOS-IT)
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)
-2.96
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
(S)-2-(thiazol-2-yl)but-3-yn-2-ol(WXC05189)
- CAS RN: 1202769-70-7
- Product Code: SSC-021131
-
(R)-2-(thiazol-2-yl)but-3-yn-2-ol(WXC05188)
- CAS RN: 1202769-72-9
- Product Code: SSC-021132
-
3-Ethynyl-3-Hydroxy-1-Methylpyrrolidin-2-One
- CAS RN: 1202769-93-4
- Product Code: SSC-021133
-
4-(2-Chloroacetyl)-7-nitro-2H-1,4-benzothiazine
- CAS RN: 1202773-08-7
- Product Code: SSC-021138
-
7-Chloro-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one
- CAS RN: 1202780-76-4
- Product Code: SSC-021140
-
![CAS 1202780-76-4 7-Chloro-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1202780-76-4.gif)
