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CAS 14565-47-0 LAURIC ACID N-HYDROXY-SUCCINIMIDE ESTER molecular structure lightbox
CAS RN: 14565-47-0

LAURIC ACID N-HYDROXY-SUCCINIMIDE ESTER

  • Product code: SSC-056913
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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: 5g
  • 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 14565-47-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

14565-47-0 / (2,5-dioxopyrrolidin-1-yl) dodecanoate

Standard CAS: 14565-47-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
14565-47-0
Multi CAS
No
Molecular Formula
C16H27NO4
Molecular Weight
297.390000
Exact Mass
297.194008
SMILES
CCCCCCCCCCCC(=O)ON1C(=O)CCC1=O
InChI
InChI=1S/C16H27NO4/c1-2-3-4-5-6-7-8-9-10-11-16(20)21-17-14(18)12-13-15(17)19/h2-13H2,1H3
InChIKey
LRKGVVJOUNKTGG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Fraction Csp3
0.81
Rotatable bonds
11
H-bond acceptors
4
Molar refractivity
79.02
TPSA
63.68

LogP / Solubility

WLOGP
3.51
MLOGP
3.1
XLogP3
4.4
Consensus LogP
3.67
Log S (ESOL)
-3.17
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.54
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.83
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.04

Drug-likeness / Medicinal Chemistry

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

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