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CAS 946491-48-1 3,6-Dibromo-9-[4-(2-ethylhexyloxy)phenyl]-9H-carbazole molecular structure lightbox
CAS RN: 946491-48-1

3,6-Dibromo-9-[4-(2-ethylhexyloxy)phenyl]-9H-carbazole

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250531 100mg / 200mg / 1g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: SSC-209775
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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: ＞97%
  • 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 946491-48-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

946491-48-1 / 3,6-dibromo-9-[4-(2-ethylhexoxy)phenyl]carbazole

Standard CAS: 946491-48-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
946491-48-1
Multi CAS
No
Molecular Formula
C26H27BR2NO
Molecular Weight
529.300000
Exact Mass
529.043890
InChI
InChI=1S/C26H27Br2NO/c1-3-5-6-18(4-2)17-30-22-11-9-21(10-12-22)29-25-13-7-19(27)15-23(25)24-16-20(28)8-14-26(24)29/h7-16,18H,3-6,17H2,1-2H3
InChIKey
ACUVALSRGHGNLZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
19
Fraction Csp3
0.31
Rotatable bonds
8
H-bond acceptors
2
Molar refractivity
134.98
TPSA
14.16

LogP / Solubility

WLOGP
8.9
MLOGP
7.87
XLogP3
9.5
Consensus LogP
8.76
Log S (ESOL)
-8.67
Class (ESOL)
Insoluble
Log S (Ali)
-10.33
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.45
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)
0.37

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
3.5

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