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CAS 905459-27-0 [1,3-Bis(2,6-Diisopropylphenyl)imidazol-2-ylidene](3-chloropyridyl)palladium(II) Dichloride molecular structure lightbox
CAS RN: 905459-27-0

[1,3-Bis(2,6-Diisopropylphenyl)imidazol-2-ylidene](3-chloropyridyl)palladium(II) Dichloride

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250930 1g In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20251008 250mg In stock Shanghai, Shandong Inquiry
Batchno.20250419 5g Out of stock 5-7 business days Inquiry
  • Product code: SSC-203069
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 10g, 1g, 5g, 25g
  • Available purity: >98%
  • Inventory rows with stock: 5
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 905459-27-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g >98% 5 In Stock Beijing Inquiry
10g >98% 4 In Stock Shenzhen Inquiry
1g >98% 2 In Stock Hong Kong Inquiry
5g >98% 1 In Stock Beijing Inquiry
25g >98% 1 In Stock Beijing Inquiry

905459-27-0 / [1,3-Bis(2,6-Diisopropylphenyl)imidazol-2-ylidene](3-chloropyridyl)palladium(II) Dichloride

Standard CAS: 905459-27-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
905459-27-0
Multi CAS
Yes
Molecular Formula
C32H40CL3N3PD
Molecular Weight
679.500000
Exact Mass
677.132260
InChI
InChI=1S/C27H36N2.C5H4ClN.2ClH.Pd/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;6-5-2-1-3-7-4-5;;;/h9-16,18-21H,1-8H3;1-4H;2*1H;/q;;;;+2/p-2
InChIKey
NLVKLFBIRDNQHR-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
39
Aromatic heavy atom count
18
Fraction Csp3
0.38
Rotatable bonds
6
H-bond acceptors
3
Molar refractivity
155.83
TPSA
19.37

LogP / Solubility

WLOGP
3.71
MLOGP
3.33
XLogP3
3.71
Consensus LogP
3.58
Log S (ESOL)
-6.34
Class (ESOL)
Insoluble
Log S (Ali)
-7.81
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.88
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-4.23

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5

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