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CAS 77989-15-2 2-(2-Bromophenyl)-4,6-diphenyl-1,3,5-triazine molecular structure lightbox
CAS RN: 77989-15-2

2-(2-Bromophenyl)-4,6-diphenyl-1,3,5-triazine

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260622 100g In stock Shanghai Inquiry
Batchno.20251108 10g In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20250828 1g In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20250218 25g In stock Shanghai Inquiry
Batchno.20250728 5g In stock Shanghai, Shenzhen Inquiry
  • Product code: SSC-187528
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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: 10g, 25g
  • 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 77989-15-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥97% 0 Out of Stock Shenzhen Inquiry
25g ≥97% 0 Out of Stock Shenzhen Inquiry

77989-15-2 / 2-(2-bromophenyl)-4,6-diphenyl-1,3,5-triazine

Standard CAS: 77989-15-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
77989-15-2
Multi CAS
No
Molecular Formula
BC21H14Rn3
Molecular Weight
388.300000
Exact Mass
387.037110
InChI
InChI=1S/C21H14BrN3/c22-18-14-8-7-13-17(18)21-24-19(15-9-3-1-4-10-15)23-20(25-21)16-11-5-2-6-12-16/h1-14H
InChIKey
MSTJGWCHJCZPEQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
24
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
103.84
TPSA
38.67

LogP / Solubility

WLOGP
5.64
MLOGP
4.98
XLogP3
5.7
Consensus LogP
5.44
Log S (ESOL)
-6.31
Class (ESOL)
Insoluble
Log S (Ali)
-6.81
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.22
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)
-1.09

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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