CAS RN: 951120-33-5
PC 190723
Product Availability
Choose a grade to view its available package options.
6 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250330 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20250316 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20250309 | 1mg / 5mg | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250416 | 25mg | Out of stock | Inquiry | ||
| Batchno.20250711 | 50mg | Out of stock | Inquiry | ||
| Batchno.20250306 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS951120-33-5
- Purity/Analytical Methods: >99.0%
951120-33-5 / 3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide
Basic Information
CAS
951120-33-5
Multi CAS
No
Molecular Formula
C14H8CLF2N3O2S
Molecular Weight
355.700000
Exact Mass
354.999382
InChI
InChI=1S/C14H8ClF2N3O2S/c15-6-3-8-14(19-4-6)23-10(20-8)5-22-9-2-1-7(16)11(12(9)17)13(18)21/h1-4H,5H2,(H2,18,21)
InChIKey
INYJNSBDHOVLAH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
15
Fraction Csp3
0.07
Rotatable bonds
4
H-bond acceptors
5
H-bond donors
1
Molar refractivity
81.63
TPSA
78.1
LogP / Solubility
WLOGP
3.3
MLOGP
2.92
XLogP3
2.8
Consensus LogP
3.01
Log S (ESOL)
-4.34
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.86
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.19
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.55
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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![CAS 951122-66-0 2-(BroMoMethyl)-6-chlorothiazolo[5,4-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/951122-66-0.gif)
