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CAS 100366-66-3 6,6”-Dibromo-2,2′:6′,2”-terpyridine molecular structure lightbox
CAS RN: 100366-66-3

6,6”-Dibromo-2,2′:6′,2”-terpyridine

Product Availability

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8 package records2 with current stock3 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250911 1g In stock Inquiry
Batchno.20251110 250mg Out of stock Inquiry
Batchno.20250314 25mg In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250518 200mg / 1g Out of stock 1 business days Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250613 100mg Out of stock Inquiry
Batchno.20250502 1g Out of stock Inquiry
Batchno.20250606 250mg Out of stock Inquiry
Batchno.20250806 5g Out of stock Inquiry
  • Product code: SSC-000870
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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: ≥94%
  • 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 100366-66-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥94% 0 Out of Stock Shanghai Inquiry

100366-66-3 / 2,6-bis(6-bromo-2-pyridinyl)pyridine

6,6''-Dibromo-2,2':6',2''-terpyridine | DTXSID90401022 | RefChem:305991

Standard CAS: 100366-66-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
100366-66-3
Multi CAS
No
Molecular Formula
C15H9Br2N3
Molecular Weight
391.060000
Exact Mass
390.914270
SMILES
C1=CC(=NC(=C1)C2=NC(=CC=C2)Br)C3=NC(=CC=C3)Br
InChI
InChI=1S/C15H9Br2N3/c16-14-8-2-6-12(19-14)10-4-1-5-11(18-10)13-7-3-9-15(17)20-13/h1-9H
InChIKey
PYMBATDYUCQLBC-UHFFFAOYSA-N
Synonyms
6,6''-Dibromo-2,2':6',2''-terpyridine DTXSID90401022 RefChem:305991 DTXCID50351877 623-737-5

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
18
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
86.1
TPSA
38.67

LogP / Solubility

WLOGP
4.73
MLOGP
4.19
XLogP3
4.2
Consensus LogP
4.37
Log S (ESOL)
-5.78
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.18
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.37
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
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)
-1.75

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (97.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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