![CAS 2098786-35-5 10-[2-(2-Methoxyethoxy)ethyl]-10H-phenothiazine molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/m3068-jpgcontextbwfzdgvyfhjvb3r8mze3ntr8aw1hz2uvanblz3xoyzyvadeylzg5mze2mtyxnje4mjivttmwnjguanbnfdrkmzuymtbhmgzjnjqwzdczywu5ztlmztjmmtk1mwewy2rhnwy4nzu5owu0otzkmze5ntcznja2y2jmodrjmji.jpeg)
CAS RN: 2098786-35-5
10-[2-(2-Methoxyethoxy)ethyl]-10H-phenothiazine
Product Availability
Choose a grade to view its available package options.
4 package records1 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260602 | 250mg / 1g / 5g / 25g | Confirm by inquiry | Shanghai, Shandong | Inquiry |
- Product code: SSC-099786
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: ＞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 |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Beijing | Inquiry |
2098786-35-5 / 10-[2-(2-methoxyethoxy)ethyl]phenothiazine
Basic Information
CAS
2098786-35-5
Multi CAS
No
Molecular Formula
C17H19NO2S
Molecular Weight
301.400000
Exact Mass
301.113650
SMILES
COCCOCCN1C2=CC=CC=C2SC3=CC=CC=C31
InChI
InChI=1S/C17H19NO2S/c1-19-12-13-20-11-10-18-14-6-2-4-8-16(14)21-17-9-5-3-7-15(17)18/h2-9H,10-13H2,1H3
InChIKey
XWOTZCDVQAKOAY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
12
Fraction Csp3
0.29
Rotatable bonds
6
H-bond acceptors
4
Molar refractivity
86.71
TPSA
21.7
LogP / Solubility
WLOGP
3.95
MLOGP
3.49
XLogP3
3.9
Consensus LogP
3.78
Log S (ESOL)
-4.23
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.89
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.62
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.75
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
