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CAS 36437-30-6 1,1′-DI-N-OCTYL-4,4′-BIPYRIDINIUM DIBROMIDE molecular structure lightbox
CAS RN: 36437-30-6

1,1′-DI-N-OCTYL-4,4′-BIPYRIDINIUM DIBROMIDE

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20251001 1g In stock Inquiry
Batchno.20250927 200mg Out of stock Inquiry
Batchno.20250112 5g In stock Inquiry
  • Product code: SSC-143620
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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: ≥98%
  • 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 36437-30-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 0 Out of Stock Shenzhen Inquiry

36437-30-6 / 1-octyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium dibromide

Standard CAS: 36437-30-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
36437-30-6
Multi CAS
Yes
Molecular Formula
C26H42BR2N2
Molecular Weight
542.400000
Exact Mass
542.169430
InChI
InChI=1S/C26H42N2.2BrH/c1-3-5-7-9-11-13-19-27-21-15-25(16-22-27)26-17-23-28(24-18-26)20-14-12-10-8-6-4-2;;/h15-18,21-24H,3-14,19-20H2,1-2H3;2*1H/q+2;;/p-2
InChIKey
GVUBEJANEHZYPA-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
12
Fraction Csp3
0.62
Rotatable bonds
15
H-bond acceptors
2
Molar refractivity
119.02
TPSA
7.76

LogP / Solubility

WLOGP
0.66
MLOGP
0.62
XLogP3
0.66
Consensus LogP
0.65
Log S (ESOL)
-2.92
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.48
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.53
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.56

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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