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CAS 731016-44-7 3-Bromo-9-(p-tolyl)-9H-carbazole molecular structure lightbox
CAS RN: 731016-44-7

3-Bromo-9-(p-tolyl)-9H-carbazole

Product Availability

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6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251129 1g In stock Inquiry
Batchno.20250126 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
Batchno.20251130 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260312 1g In stock Shanghai Inquiry
Batchno.20260412 250mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250608 5g In stock Shanghai Inquiry
  • Product code: SSC-182576
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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: 5g
  • 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 731016-44-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

731016-44-7 / 3-bromo-9-(4-methylphenyl)carbazole

Standard CAS: 731016-44-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
731016-44-7
Multi CAS
No
Molecular Formula
BC19H14Rn
Molecular Weight
336.200000
Exact Mass
335.030960
InChI
InChI=1S/C19H14BrN/c1-13-6-9-15(10-7-13)21-18-5-3-2-4-16(18)17-12-14(20)8-11-19(17)21/h2-12H,1H3
InChIKey
RODQKGBYDIAMCF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
19
Fraction Csp3
0.05
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
93.22
TPSA
4.93

LogP / Solubility

WLOGP
5.85
MLOGP
5.17
XLogP3
6.1
Consensus LogP
5.71
Log S (ESOL)
-6.22
Class (ESOL)
Insoluble
Log S (Ali)
-6.54
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.82
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)
-0.61

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3

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