CAS RN: 24910-32-5
Ethanol, 2,2′-(pentadecylimino)bis-
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260308 | 25mg / 100mg / 500mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS24910-32-5
- Purity/Analytical Methods: >99.0%
24910-32-5 / 2-[2-hydroxyethyl(pentadecyl)amino]ethanol
Basic Information
CAS
24910-32-5
Multi CAS
No
Molecular Formula
C19H41NO2
Molecular Weight
315.500000
Exact Mass
315.313730
SMILES
CCCCCCCCCCCCCCCN(CCO)CCO
InChI
InChI=1S/C19H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(16-18-21)17-19-22/h21-22H,2-19H2,1H3
InChIKey
MOVFFQCDGPWQOJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Fraction Csp3
1
Rotatable bonds
18
H-bond acceptors
3
H-bond donors
2
Molar refractivity
96.31
TPSA
43.7
LogP / Solubility
WLOGP
4.36
MLOGP
3.85
XLogP3
6.1
Consensus LogP
4.77
Log S (ESOL)
-3.36
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.3
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-7.49
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.55
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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