![CAS 774589-47-8 1-(4-(4-(benzo[d][1,3]dioxole-5-carbonyl)piperazin-1-yl)phenyl)ethan-1-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/774589-47-8.gif)
CAS RN: 774589-47-8
1-(4-(4-(benzo[d][1,3]dioxole-5-carbonyl)piperazin-1-yl)phenyl)ethan-1-one
Product Availability
Choose a grade to view its available package options.
8 package records6 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260326 | 1mg / 5mg / 10mg / 25mg / 50mg / 100mg | Confirm by inquiry | Shanghai | 8-10 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260207 | 100mg | Out of stock | Inquiry | ||
| Batchno.20251108 | 10mg | In stock | Shanghai, Wuhan | Inquiry | |
| Batchno.20250708 | 1mg | In stock | Shanghai, Wuhan | Inquiry | |
| Batchno.20250724 | 250mg | Out of stock | Inquiry | ||
| Batchno.20251005 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20260113 | 50mg | In stock | Shenzhen | Inquiry | |
| Batchno.20250620 | 5mg | In stock | Shanghai, Wuhan | Inquiry |
- Product code: starshine_CAS774589-47-8
- Purity/Analytical Methods: >99.0%
774589-47-8 / 1-[4-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]phenyl]ethanone
Basic Information
CAS
774589-47-8
Multi CAS
No
Molecular Formula
C20H20N2O4
Molecular Weight
352.400000
Exact Mass
352.142307
InChI
InChI=1S/C20H20N2O4/c1-14(23)15-2-5-17(6-3-15)21-8-10-22(11-9-21)20(24)16-4-7-18-19(12-16)26-13-25-18/h2-7,12H,8-11,13H2,1H3
InChIKey
DMJGPASMZSNEAZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
12
Fraction Csp3
0.3
Rotatable bonds
3
H-bond acceptors
5
Molar refractivity
97.13
TPSA
59.08
LogP / Solubility
WLOGP
2.58
MLOGP
2.29
XLogP3
2.5
Consensus LogP
2.46
Log S (ESOL)
-3.79
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.31
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.45
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.04
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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![CAS 774597-13-6 4H-1,3,6,2-Dioxazaborocine, tetrahydro-2-[(2E)-3-(trimethylsilyl)-2-propen-1-yl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/774597-13-6.gif)
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