CAS RN: 912922-58-8
2,2′,2”,5′-Tetrabromo-1,1′:4′,1”-terphenyl
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.20250914 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS912922-58-8
- Purity/Analytical Methods: >99.0%
912922-58-8 / 1,4-dibromo-2,5-bis(2-bromophenyl)benzene
Basic Information
CAS
912922-58-8
Multi CAS
No
Molecular Formula
C18H10BR4
Molecular Weight
545.900000
Exact Mass
545.747500
InChI
InChI=1S/C18H10Br4/c19-15-7-3-1-5-11(15)13-9-18(22)14(10-17(13)21)12-6-2-4-8-16(12)20/h1-10H
InChIKey
BRXVFKOIXGTYLP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
18
Rotatable bonds
2
Molar refractivity
108.11
TPSA
0.0000
LogP / Solubility
WLOGP
8.07
MLOGP
7.14
XLogP3
7.9
Consensus LogP
7.7
Log S (ESOL)
-8.78
Class (ESOL)
Insoluble
Log S (Ali)
-9.86
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.15
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.32
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
2.5
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