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CAS 1890136-54-5 2-Bromo-5′-phenyl-1,1′:3′,1”-terphenyl molecular structure lightbox
CAS RN: 1890136-54-5

2-Bromo-5′-phenyl-1,1′:3′,1”-terphenyl

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250212 200mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-088100
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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 1890136-54-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Hong Kong Inquiry

1890136-54-5 / 1-(2-bromophenyl)-3,5-diphenylbenzene

Standard CAS: 1890136-54-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1890136-54-5
Multi CAS
No
Molecular Formula
C24H17Br
Molecular Weight
385.300000
Exact Mass
384.051360
SMILES
C1=CC=C(C=C1)C2=CC(=CC(=C2)C3=CC=CC=C3Br)C4=CC=CC=C4
InChI
InChI=1S/C24H17Br/c25-24-14-8-7-13-23(24)22-16-20(18-9-3-1-4-10-18)15-21(17-22)19-11-5-2-6-12-19/h1-17H
InChIKey
JZTPJDDVFCPFKR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
24
Rotatable bonds
3
Molar refractivity
110.45
TPSA
0.0000

LogP / Solubility

WLOGP
7.45
MLOGP
6.58
XLogP3
7.8
Consensus LogP
7.28
Log S (ESOL)
-7.43
Class (ESOL)
Insoluble
Log S (Ali)
-8.1
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.71
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)
0.22

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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