[email protected]
CAS 603109-48-4 Di-μ-chlorotetrakis[2-(2-pyridinyl-kN)phenyl-kC]diiridium(III) molecular structure lightbox
CAS RN: 603109-48-4

Di-μ-chlorotetrakis[2-(2-pyridinyl-kN)phenyl-kC]diiridium(III)

Product Availability

Choose a grade to view its available package options.

3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250508 100mg In stock Shanghai Inquiry
Batchno.20250813 1g In stock Shanghai Inquiry
Batchno.20250724 250mg In stock Shanghai Inquiry
  • Product code: starshine_CAS603109-48-4
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

603109-48-4 / bis(chloroiridium(2+));tetrakis(2-phenylpyridine)

Standard CAS: 603109-48-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
603109-48-4
Multi CAS
Yes
Molecular Formula
C44H32CL2IR2N4
Molecular Weight
1072.100000
Exact Mass
1070.123920
InChI
InChI=1S/4C11H8N.2ClH.2Ir/c4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;/h4*1-6,8-9H;2*1H;;/q4*-1;;;2*+3/p-2
InChIKey
LCEYXICNCJSAHX-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
52
Aromatic heavy atom count
48
Rotatable bonds
4
H-bond acceptors
4
Molar refractivity
205.74
TPSA
51.56

LogP / Solubility

WLOGP
11.57
MLOGP
10.29
XLogP3
11.57
Consensus LogP
11.14
Log S (ESOL)
-14.19
Class (ESOL)
Insoluble
Log S (Ali)
-16.7
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-16.71
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.05

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6.5

Customers Also Viewed

Get In Touch

Contact Us