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CAS 16260-09-6 (Z)-N-octadec-9-enylhexadecan-1-amide molecular structure lightbox
CAS RN: 16260-09-6

(Z)-N-octadec-9-enylhexadecan-1-amide

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250918 50mg / 250mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS16260-09-6
  • Purity/Analytical Methods: >99.0%
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16260-09-6 / N-[(Z)-octadec-9-enyl]hexadecanamide

Standard CAS: 16260-09-6 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
16260-09-6
Multi CAS
No
Molecular Formula
C34H67NO
Molecular Weight
505.900000
Exact Mass
505.522266
SMILES
CCCCCCCCCCCCCCCC(=O)NCCCCCCCC/C=C\CCCCCCCC
InChI
InChI=1S/C34H67NO/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-33-35-34(36)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h17-18H,3-16,19-33H2,1-2H3,(H,35,36)/b18-17-
InChIKey
VMRGZRVLZQSNHC-ZCXUNETKSA-N

Physical Properties

Physical Description
Dry Powder; Pellets or Large Crystals
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
36
Fraction Csp3
0.91
Rotatable bonds
30
H-bond acceptors
1
H-bond donors
1
Molar refractivity
162.77
TPSA
29.1

LogP / Solubility

WLOGP
11.62
MLOGP
10.26
XLogP3
14.8
Consensus LogP
12.23
Log S (ESOL)
-8.32
Class (ESOL)
Insoluble
Log S (Ali)
-12.1
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-16.19
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)
2.45

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 116 of 117 companies (only 0.9% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

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