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CAS 601454-33-5 9-(4-Bromophenyl)-3,6-di-tert-butylcarbazole molecular structure lightbox
CAS RN: 601454-33-5

9-(4-Bromophenyl)-3,6-di-tert-butylcarbazole

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250604 1g In stock Inquiry
Batchno.20251110 200mg / 1g / 5g / 25g Confirm by inquiry Shanghai, Shandong 8-10 business days Inquiry
Batchno.20250916 250mg In stock Inquiry
Batchno.20250722 25g In stock Inquiry
Batchno.20251005 5g In stock Inquiry
  • Product code: SSC-168710
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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 601454-33-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥97% 0 Out of Stock Shenzhen Inquiry

601454-33-5 / 9-(4-bromophenyl)-3,6-ditert-butylcarbazole

Standard CAS: 601454-33-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
601454-33-5
Multi CAS
No
Molecular Formula
BC26H28Rn
Molecular Weight
434.400000
Exact Mass
433.140510
InChI
InChI=1S/C26H28BrN/c1-25(2,3)17-7-13-23-21(15-17)22-16-18(26(4,5)6)8-14-24(22)28(23)20-11-9-19(27)10-12-20/h7-16H,1-6H3
InChIKey
LAHSPJHDQUQBTB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
28
Aromatic heavy atom count
19
Fraction Csp3
0.31
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
125.88
TPSA
4.93

LogP / Solubility

WLOGP
8.14
MLOGP
7.19
XLogP3
9
Consensus LogP
8.11
Log S (ESOL)
-8.1
Class (ESOL)
Insoluble
Log S (Ali)
-9
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.36
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)
0.41

Drug-likeness / Medicinal Chemistry

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

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