CAS RN: 215923-54-9
CX546 (1-(1,4-BENZODIOXAN-6-YLCARBONYL)P
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.20260316 | 10mg / 50mg / 100mg | Confirm by inquiry | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250418 | 100mg | Out of stock | Inquiry | |
| Batchno.20250408 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20260122 | 1g | Out of stock | Inquiry | |
| Batchno.20260104 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20260201 | 250mg | Out of stock | Inquiry | |
| Batchno.20251027 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20251114 | 50mg | Out of stock | Inquiry |
- Product code: starshine_CAS215923-54-9
- Purity/Analytical Methods: >99.0%
215923-54-9 / 2,3-dihydro-1,4-benzodioxin-6-yl(piperidin-1-yl)methanone
Basic Information
CAS
215923-54-9
Multi CAS
No
Molecular Formula
C14H17NO3
Molecular Weight
247.290000
Exact Mass
247.120843
SMILES
C1CCN(CC1)C(=O)C2=CC3=C(C=C2)OCCO3
InChI
InChI=1S/C14H17NO3/c16-14(15-6-2-1-3-7-15)11-4-5-12-13(10-11)18-9-8-17-12/h4-5,10H,1-3,6-9H2
InChIKey
LJUNPHMOGNFFOS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
67.19
TPSA
38.77
LogP / Solubility
WLOGP
2.08
MLOGP
1.84
XLogP3
1.1
Consensus LogP
1.67
Log S (ESOL)
-2.87
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.09
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.12
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.75
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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