![CAS 26815-04-3 4-[2-(1-Piperidinyl)ethoxy]benzaldehyde molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/26815-04-3.gif)
CAS RN: 26815-04-3
4-[2-(1-Piperidinyl)ethoxy]benzaldehyde
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.20250722 | 100mg / 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS26815-04-3
- Purity/Analytical Methods: >99.0%
26815-04-3 / 4-(2-piperidin-1-ylethoxy)benzaldehyde
Basic Information
CAS
26815-04-3
Multi CAS
No
Molecular Formula
C14H19NO2
Molecular Weight
233.310000
Exact Mass
233.141579
SMILES
C1CCN(CC1)CCOC2=CC=C(C=C2)C=O
InChI
InChI=1S/C14H19NO2/c16-12-13-4-6-14(7-5-13)17-11-10-15-8-2-1-3-9-15/h4-7,12H,1-3,8-11H2
InChIKey
WCLJTEXCGGSJJN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
5
H-bond acceptors
3
Molar refractivity
67.62
TPSA
29.54
LogP / Solubility
WLOGP
2.36
MLOGP
2.08
XLogP3
2.2
Consensus LogP
2.21
Log S (ESOL)
-2.71
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.18
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.74
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)
-2.46
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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- CAS RN: 26820-61-1
- Product Code: starshine_CAS26820-61-1
- Purity/Analytical method: >99.0%
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