CAS RN: 81480-40-2
OLEIC ACID N-HYDROXYSUCCINIMIDE ESTER
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.20250117 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS81480-40-2
- Purity/Analytical Methods: >99.0%
81480-40-2 / (2,5-dioxopyrrolidin-1-yl) octadec-9-enoate
Basic Information
CAS
81480-40-2
Multi CAS
Yes
Molecular Formula
C22H37NO4
Molecular Weight
379.500000
Exact Mass
379.272259
InChI
InChI=1S/C22H37NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(26)27-23-20(24)18-19-21(23)25/h9-10H,2-8,11-19H2,1H3/b10-9-
InChIKey
MAKGRQMFNNEEKW-KTKRTIGZSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Fraction Csp3
0.77
Rotatable bonds
16
H-bond acceptors
4
Molar refractivity
106.63
TPSA
63.68
LogP / Solubility
WLOGP
5.63
MLOGP
4.98
XLogP3
6.7
Consensus LogP
5.77
Log S (ESOL)
-4.68
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.74
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.72
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.04
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
Polyprenic
- CAS RN: 81485-25-8
- Product Code: starshine_CAS81485-25-8
- Purity/Analytical method: >99.0%
-
2-METHYL-1,2,3,4-TETRAHYDROQUINOLIN-8-OL HYDROCHLORIDE
- CAS RN: 81485-78-1
- Product Code: SSC-189913
-
3,4-dihydro-2H-chromene-3,8-diol
- CAS RN: 81486-17-1
- Product Code: starshine_CAS81486-17-1
- Purity/Analytical method: >99.0%
-
3,4-Dihydro-2H-1-benzopyran-3,8-diol 3-nitrate
- CAS RN: 81486-20-6
- Product Code: SSC-189914
-
-
![CAS 81487-04-9 exo-8-Methyl-3-aMino-azabicyclo[3.2.1]octane molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/81487-04-9.gif)
