CAS RN: 2376733-15-0
4-(5-bromo[1,1′-biphenyl]-2-yl)-dibenzofuran
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20250214 |
100mg / 250mg / 1g |
Out of stock |
5-7 business days | Inquiry |
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Product code:
starshine_CAS2376733-15-0
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Purity/Analytical Methods:
>99.0%
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2376733-15-0 / 4-(4-bromo-2-phenylphenyl)dibenzofuran
Standard CAS: 2376733-15-0
Multi CAS: No
Basic Information
CAS
2376733-15-0
Multi CAS
No
Molecular Formula
C24H15BrO
Molecular Weight
399.300000
Exact Mass
398.030630
SMILES
C1=CC=C(C=C1)C2=C(C=CC(=C2)Br)C3=CC=CC4=C3OC5=CC=CC=C45
InChI
InChI=1S/C24H15BrO/c25-17-13-14-18(22(15-17)16-7-2-1-3-8-16)20-10-6-11-21-19-9-4-5-12-23(19)26-24(20)21/h1-15H
InChIKey
ZOJHMSYAQXBSQR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
25
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
112.29
TPSA
13.14
LogP / Solubility
WLOGP
7.68
MLOGP
6.78
XLogP3
7.6
Consensus LogP
7.35
Log S (ESOL)
-7.74
Class (ESOL)
Insoluble
Log S (Ali)
-8.38
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.87
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)
0.3
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5