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CAS 23949-66-8 N-(2-Ethoxyphenyl)-N’-(4-ethylphenyl)-ethlyene diamide molecular structure lightbox
CAS RN: 23949-66-8

N-(2-Ethoxyphenyl)-N’-(4-ethylphenyl)-ethlyene diamide

  • Product code: SSC-116899
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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 23949-66-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

23949-66-8 / N'-(2-ethoxyphenyl)-N-(2-ethylphenyl)oxamide

Standard CAS: 23949-66-8 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
23949-66-8
Multi CAS
No
Molecular Formula
C18H20N2O3
Molecular Weight
312.400000
Exact Mass
312.147393
SMILES
CCC1=CC=CC=C1NC(=O)C(=O)NC2=CC=CC=C2OCC
InChI
InChI=1S/C18H20N2O3/c1-3-13-9-5-6-10-14(13)19-17(21)18(22)20-15-11-7-8-12-16(15)23-4-2/h5-12H,3-4H2,1-2H3,(H,19,21)(H,20,22)
InChIKey
YIMHRDBSVCPJOV-UHFFFAOYSA-N

Physical Properties

Physical Description
Dry Powder; Other Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.22
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
2
Molar refractivity
90.69
TPSA
67.43

LogP / Solubility

WLOGP
3.22
MLOGP
2.85
XLogP3
3.5
Consensus LogP
3.19
Log S (ESOL)
-3.86
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.45
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.97
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.34

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5

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