CAS RN: 40952-11-2
N-tetradecylacrylamide
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.20250907 | 100mg / 250mg / 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS40952-11-2
- Purity/Analytical Methods: >99.0%
40952-11-2 / N-tetradecylprop-2-enamide
Basic Information
CAS
40952-11-2
Multi CAS
No
Molecular Formula
C17H33NO
Molecular Weight
267.400000
Exact Mass
267.256215
InChI
InChI=1S/C17H33NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-18-17(19)4-2/h4H,2-3,5-16H2,1H3,(H,18,19)
InChIKey
DBLNSVZHOZOZQX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Fraction Csp3
0.82
Rotatable bonds
14
H-bond acceptors
1
H-bond donors
1
Molar refractivity
84.28
TPSA
29.1
LogP / Solubility
WLOGP
4.99
MLOGP
4.4
XLogP3
6.8
Consensus LogP
5.4
Log S (ESOL)
-3.72
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.36
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-7.22
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.81
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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