CAS RN: 915759-45-4
WAY-316606
Product Availability
Choose a grade to view its available package options.
8 package records4 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251024 | 5mg / 10mg / 25mg / 100mg / 500mg | Confirm by inquiry | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250309 | 100mg | Out of stock | Inquiry | |
| Batchno.20250512 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250113 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250515 | 250mg | Out of stock | Inquiry | |
| Batchno.20260208 | 25mg | Out of stock | Inquiry | |
| Batchno.20250430 | 50mg | Out of stock | Inquiry | |
| Batchno.20250630 | 5mg | In stock | Shanghai | Inquiry |
- Product code: LINW899668
915759-45-4 / 5-(benzenesulfonyl)-N-piperidin-4-yl-2-(trifluoromethyl)benzenesulfonamide
Basic Information
CAS
915759-45-4
Multi CAS
No
Molecular Formula
C18F3H19N2O4S2
Molecular Weight
448.500000
Exact Mass
448.073834
InChI
InChI=1S/C18H19F3N2O4S2/c19-18(20,21)16-7-6-15(28(24,25)14-4-2-1-3-5-14)12-17(16)29(26,27)23-13-8-10-22-11-9-13/h1-7,12-13,22-23H,8-11H2
InChIKey
ITBGJNVZJBVPLJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Aromatic heavy atom count
12
Fraction Csp3
0.33
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
2
Molar refractivity
99.55
TPSA
92.34
LogP / Solubility
WLOGP
2.57
MLOGP
2.29
XLogP3
2.7
Consensus LogP
2.52
Log S (ESOL)
-4.21
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.09
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.31
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.63
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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