![CAS 1825392-15-1 2-(2-(2-(2-(4-(Dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl)ethoxy)ethoxy)ethoxy)ethanol dihydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1825392-15-1.gif)
CAS RN: 1825392-15-1
2-(2-(2-(2-(4-(Dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl)ethoxy)ethoxy)ethoxy)ethanol dihydrochloride
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.20250412 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-084538
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 | Hong Kong | Inquiry |
1825392-15-1 / 2-[2-[2-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethoxy]ethoxy]ethanol;dihydrochloride
Basic Information
CAS
1825392-15-1
Multi CAS
No
Molecular Formula
C25H35Cl2N3O4S
Molecular Weight
544.500000
Exact Mass
543.172533
SMILES
C1CN(CCN1CCOCCOCCOCCO)C2=NC3=CC=CC=C3SC4=CC=CC=C42.Cl.Cl
InChI
InChI=1S/C25H33N3O4S.2ClH/c29-14-16-31-18-20-32-19-17-30-15-13-27-9-11-28(12-10-27)25-21-5-1-3-7-23(21)33-24-8-4-2-6-22(24)26-25;;/h1-8,29H,9-20H2;2*1H
InChIKey
RCCYSOYYXOWCJC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
35
Aromatic heavy atom count
12
Fraction Csp3
0.48
Rotatable bonds
11
H-bond acceptors
8
H-bond donors
1
Molar refractivity
145.26
TPSA
66.76
LogP / Solubility
WLOGP
3.73
MLOGP
3.33
XLogP3
3.73
Consensus LogP
3.6
Log S (ESOL)
-5.1
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.72
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.62
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.39
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
Bis(3-ethynylbenzyl)amine
- CAS RN: 1825394-89-5
- Product Code: starshine_CAS1825394-89-5
- Purity/Analytical method: >99.0%
-
Methyl 5-chloropyrazolo[1,5-a]pyridine-3-carboxylate
- CAS RN: 1825395-08-1
- Product Code: starshine_CAS1825395-08-1
- Purity/Analytical method: >99.0%
-
ZLD-1039
- CAS RN: 1826865-46-6
- Product Code: starshine_CAS1826865-46-6
- Purity/Analytical method: >99.0%
-
3-fluorobicyclo[1.1.1]pentan-1-amine hydrochloride(WX120752S1)
- CAS RN: 1826900-79-1
- Product Code: SSC-084576
-
tert-butyl (3-fluorobicyclo[1.1.1]pentan-1-yl)carbamate(WX120747)
- CAS RN: 1826900-85-9
- Product Code: SSC-084577
-
![CAS 1825395-08-1 Methyl 5-chloropyrazolo[1,5-a]pyridine-3-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1825395-08-1.gif)
![CAS 1826900-79-1 3-fluorobicyclo[1.1.1]pentan-1-amine hydrochloride(WX120752S1) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1826900-79-1.gif)
![CAS 1826900-85-9 tert-butyl (3-fluorobicyclo[1.1.1]pentan-1-yl)carbamate(WX120747) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1826900-85-9.gif)
