![CAS 2682-45-3 2-Methylnaphtho[1,2-d]thiazole molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/m1287-jpgcontextbwfzdgvyfhjvb3r8mzcwnzn8aw1hz2uvanblz3xom2mvagu2lzg5mze0mjc2mtq3ntavtteyodcuanbnfdu2mti0mdk2zjawyjuxmdixotkwyzeynznknziwzwnjn2vjngnlzte0mgjhnwrmn2rhmwi3njm3ytzhytu3zta.jpeg)
CAS RN: 2682-45-3
2-Methylnaphtho[1,2-d]thiazole
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock1 grade group
- Product code: SSC-125091
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: 25g
- Available purity: ≥97%
- 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 |
|---|---|---|---|---|
| 25g | ≥97% | 0 Out of Stock | Shanghai | Inquiry |
2682-45-3 / 2-methylbenzo[e][1,3]benzothiazole
Basic Information
CAS
2682-45-3
Multi CAS
No
Molecular Formula
C12H9NS
Molecular Weight
199.270000
Exact Mass
199.045570
SMILES
CC1=NC2=C(S1)C=CC3=CC=CC=C32
InChI
InChI=1S/C12H9NS/c1-8-13-12-10-5-3-2-4-9(10)6-7-11(12)14-8/h2-7H,1H3
InChIKey
OUXMJRMYZCEVKO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
13
Fraction Csp3
0.08
H-bond acceptors
2
Molar refractivity
61.86
TPSA
12.89
LogP / Solubility
WLOGP
3.76
MLOGP
3.31
XLogP3
4
Consensus LogP
3.69
Log S (ESOL)
-4.13
Class (ESOL)
Slightly soluble
Log S (Ali)
-3.91
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.07
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.27
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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![CAS 49762-08-5 3-Hydroxy-4-methyl-2(3H)-thiazolethione [for Source of Alkyl Radical] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/h0902-jpgcontextbwfzdgvyfhjvb3r8mzy3nzd8aw1hz2uvanblz3xom2ivadzhlzg5mza5njg0mdm5otgvsda5mdiuanbnfgmwmme0odblzdewyjq0zdy5mgu5zjriotdlyjc4zwvizjkwytawztc2ngeynzk1mguxytuwotrinzc5mdaynjq.jpeg)
