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CAS 69888-87-5 Arachidic Acid N-HydroxysucciniMide Ester molecular structure lightbox
CAS RN: 69888-87-5

Arachidic Acid N-HydroxysucciniMide Ester

  • Product code: SSC-179648
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 69888-87-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

69888-87-5 / (2,5-dioxopyrrolidin-1-yl) icosanoate

Standard CAS: 69888-87-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
69888-87-5
Multi CAS
No
Molecular Formula
C24H43NO4
Molecular Weight
409.600000
Exact Mass
409.319209
InChI
InChI=1S/C24H43NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24(28)29-25-22(26)20-21-23(25)27/h2-21H2,1H3
InChIKey
NWQWMRGPQVJCNH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
29
Fraction Csp3
0.88
Rotatable bonds
19
H-bond acceptors
4
Molar refractivity
115.96
TPSA
63.68

LogP / Solubility

WLOGP
6.64
MLOGP
5.86
XLogP3
8.7
Consensus LogP
7.07
Log S (ESOL)
-5.31
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.71
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.11
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)
-0.51

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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