CAS RN: 502693-09-6
Bis(isothiocyanato)(2,2′-bipyridyl-4,4′-dicarboxylato)(4,4′-dinonyl-2,2′-bipyridyl)ruthenium(II)
Product Availability
Choose a grade to view its available package options.
9 package records6 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251004 | 25mg / 100mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250821 | 100mg | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260105 | 1g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260522 | 250mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250821 | 5g | In stock | Shenzhen, Chengdu | Inquiry |
- Product code: SSC-156710
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
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Shanghai | Inquiry |
502693-09-6 / 2-(4-carboxy-2-pyridinyl)pyridine-4-carboxylic acid;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;ruthenium(2+);diisothiocyanate
Basic Information
CAS
502693-09-6
Multi CAS
Yes
Molecular Formula
C42H52N6O4RuS2
Molecular Weight
870.100000
Exact Mass
870.253487
InChI
InChI=1S/C28H44N2.C12H8N2O4.2CNS.Ru/c1-3-5-7-9-11-13-15-17-25-19-21-29-27(23-25)28-24-26(20-22-30-28)18-16-14-12-10-8-6-4-2;15-11(16)7-1-3-13-9(5-7)10-6-8(12(17)18)2-4-14-10;2*2-1-3;/h19-24H,3-18H2,1-2H3;1-6H,(H,15,16)(H,17,18);;;/q;;2*-1;+2
InChIKey
LALSZYPVVQFXIC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
55
Aromatic heavy atom count
24
Fraction Csp3
0.43
Rotatable bonds
20
H-bond acceptors
8
H-bond donors
2
Molar refractivity
224.16
TPSA
170.76
LogP / Solubility
WLOGP
11.58
MLOGP
10.27
XLogP3
11.58
Consensus LogP
11.14
Log S (ESOL)
-11.54
Class (ESOL)
Insoluble
Log S (Ali)
-15.06
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-17.33
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.2
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4.5
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