CAS RN: 653573-60-5
Sodium Channel inhibitor 2
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.20250422 | 1mg / 5mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS653573-60-5
- Purity/Analytical Methods: >99.0%
653573-60-5 / 2-[3-(3,4-dichlorophenoxy)phenyl]-1-(2-piperidin-1-ylethyl)benzimidazole
Basic Information
CAS
653573-60-5
Multi CAS
No
Molecular Formula
C26H25CL2N3O
Molecular Weight
466.400000
Exact Mass
465.137468
InChI
InChI=1S/C26H25Cl2N3O/c27-22-12-11-21(18-23(22)28)32-20-8-6-7-19(17-20)26-29-24-9-2-3-10-25(24)31(26)16-15-30-13-4-1-5-14-30/h2-3,6-12,17-18H,1,4-5,13-16H2
InChIKey
MLHTWZWDLJAELM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
32
Aromatic heavy atom count
21
Fraction Csp3
0.27
Rotatable bonds
6
H-bond acceptors
4
Molar refractivity
132
TPSA
30.29
LogP / Solubility
WLOGP
7.29
MLOGP
6.45
XLogP3
6.7
Consensus LogP
6.81
Log S (ESOL)
-7.41
Class (ESOL)
Insoluble
Log S (Ali)
-8.65
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.46
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.39
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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