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CAS 78525-34-5 Tetrakis(4-aminophenyl)ethene molecular structure lightbox
CAS RN: 78525-34-5

Tetrakis(4-aminophenyl)ethene

  • Product code: SSC-187907
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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 78525-34-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

78525-34-5 / 4-[1,2,2-tris(4-aminophenyl)ethenyl]aniline

Standard CAS: 78525-34-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
78525-34-5
Multi CAS
Yes
Molecular Formula
C26H24N4
Molecular Weight
392.500000
Exact Mass
392.200097
InChI
InChI=1S/C26H24N4/c27-21-9-1-17(2-10-21)25(18-3-11-22(28)12-4-18)26(19-5-13-23(29)14-6-19)20-7-15-24(30)16-8-20/h1-16H,27-30H2
InChIKey
JGUVAGVIFMBVCK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
24
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
4
Molar refractivity
128.44
TPSA
104.08

LogP / Solubility

WLOGP
5.02
MLOGP
4.44
XLogP3
5.2
Consensus LogP
4.89
Log S (ESOL)
-5.77
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.41
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.86
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.55

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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