CAS RN: 1548450-59-4
4-bromo-9-methyl-9-phenyl-9H-fluorene
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.20250507 | 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-064186
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: 5g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | ≥95% | 0 Out of Stock | Beijing | Inquiry |
1548450-59-4 / 4-bromo-9-methyl-9-phenylfluorene
Basic Information
CAS
1548450-59-4
Multi CAS
No
Molecular Formula
C20H15Br
Molecular Weight
335.200000
Exact Mass
334.035710
SMILES
CC1(C2=C(C3=CC=CC=C31)C(=CC=C2)Br)C4=CC=CC=C4
InChI
InChI=1S/C20H15Br/c1-20(14-8-3-2-4-9-14)16-11-6-5-10-15(16)19-17(20)12-7-13-18(19)21/h2-13H,1H3
InChIKey
PZZHUKPHKDLYAD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
18
Fraction Csp3
0.1
Rotatable bonds
1
Molar refractivity
91.58
TPSA
0.0000
LogP / Solubility
WLOGP
5.78
MLOGP
5.11
XLogP3
6.2
Consensus LogP
5.7
Log S (ESOL)
-6.13
Class (ESOL)
Insoluble
Log S (Ali)
-6.48
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.76
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
No
Log Kp (skin permeation)
-0.66
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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