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CAS 68578-78-9 1,2-Bis(4-methoxyphenyl)-1,2-diphenylethene molecular structure lightbox
CAS RN: 68578-78-9

1,2-Bis(4-methoxyphenyl)-1,2-diphenylethene

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4 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260616 1g In stock Shanghai Inquiry
Batchno.20260111 1g / 5g / 25g Out of stock 8-10 business days Inquiry
Batchno.20250925 25g Out of stock Inquiry
Batchno.20260403 5g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
  • Product code: starshine_CAS68578-78-9
  • Purity/Analytical Methods: >99.0%
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68578-78-9 / 1-methoxy-4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]benzene

Standard CAS: 68578-78-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
68578-78-9
Multi CAS
Yes
Molecular Formula
C28H24O2
Molecular Weight
392.500000
Exact Mass
392.177630
InChI
InChI=1S/C28H24O2/c1-29-25-17-13-23(14-18-25)27(21-9-5-3-6-10-21)28(22-11-7-4-8-12-22)24-15-19-26(30-2)20-16-24/h3-20H,1-2H3/b28-27+
InChIKey
SJCRDTOTGDVNJD-BYYHNAKLSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
24
Fraction Csp3
0.07
Rotatable bonds
6
H-bond acceptors
2
Molar refractivity
123.89
TPSA
18.46

LogP / Solubility

WLOGP
6.71
MLOGP
5.93
XLogP3
7.9
Consensus LogP
6.85
Log S (ESOL)
-6.7
Class (ESOL)
Insoluble
Log S (Ali)
-7.62
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.5
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.35

Drug-likeness / Medicinal Chemistry

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

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