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CAS 607739-92-4 9-(4-bromophenyl)-3,6-diphenyl-9H-carbazole molecular structure lightbox
CAS RN: 607739-92-4

9-(4-bromophenyl)-3,6-diphenyl-9H-carbazole

  • Product code: SSC-169431
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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: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 607739-92-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

607739-92-4 / 9-(4-bromophenyl)-3,6-diphenylcarbazole

Standard CAS: 607739-92-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
607739-92-4
Multi CAS
No
Molecular Formula
BC30H20Rn
Molecular Weight
474.400000
Exact Mass
473.077910
InChI
InChI=1S/C30H20BrN/c31-25-13-15-26(16-14-25)32-29-17-11-23(21-7-3-1-4-8-21)19-27(29)28-20-24(12-18-30(28)32)22-9-5-2-6-10-22/h1-20H
InChIKey
WOOAKXXQTAVKGL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
31
Rotatable bonds
3
H-bond acceptors
1
Molar refractivity
139.35
TPSA
4.93

LogP / Solubility

WLOGP
8.88
MLOGP
7.85
XLogP3
8.9
Consensus LogP
8.54
Log S (ESOL)
-8.89
Class (ESOL)
Insoluble
Log S (Ali)
-9.86
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.47
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)
0.69

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4

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