CAS RN: 142878-37-3
4-bromo-p-quaterphenyl
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250520 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS142878-37-3
- Purity/Analytical Methods: >99.0%
142878-37-3 / 1-bromo-4-[4-(4-phenylphenyl)phenyl]benzene
Basic Information
CAS
142878-37-3
Multi CAS
No
Molecular Formula
C24H17Br
Molecular Weight
385.300000
Exact Mass
384.051360
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)Br
InChI
InChI=1S/C24H17Br/c25-24-16-14-23(15-17-24)22-12-10-21(11-13-22)20-8-6-19(7-9-20)18-4-2-1-3-5-18/h1-17H
InChIKey
DHMHNTVOXQOWMR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
24
Rotatable bonds
3
Molar refractivity
110.45
TPSA
0.0000
LogP / Solubility
WLOGP
7.45
MLOGP
6.58
XLogP3
7.9
Consensus LogP
7.31
Log S (ESOL)
-7.43
Class (ESOL)
Insoluble
Log S (Ali)
-8.1
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.71
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)
0.22
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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