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CAS 18024-34-5 Dichloro(DPPE)digold(I) molecular structure lightbox
CAS RN: 18024-34-5

Dichloro(DPPE)digold(I)

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250130 100mg In stock Shanghai Inquiry
Batchno.20250624 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
Batchno.20260701 1g In stock Shanghai Inquiry
Batchno.20250525 250mg In stock Shanghai Inquiry
Batchno.20251219 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS18024-34-5
  • Purity/Analytical Methods: >99.0%
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18024-34-5 / chlorogold;2-diphenylphosphanylethyl(diphenyl)phosphane

Standard CAS: 18024-34-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
18024-34-5
Multi CAS
No
Molecular Formula
C26H24Au2Cl2P2
Molecular Weight
863.300000
Exact Mass
862.006170
SMILES
C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.Cl[Au].Cl[Au]
InChI
InChI=1S/C26H24P2.2Au.2ClH/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;;;;/h1-20H,21-22H2;;;2*1H/q;2*+1;;/p-2
InChIKey
VYRCUTQUNKAXBM-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
24
Fraction Csp3
0.08
Rotatable bonds
7
Molar refractivity
139.58
TPSA
0.0000

LogP / Solubility

WLOGP
6.63
MLOGP
5.91
XLogP3
6.63
Consensus LogP
6.39
Log S (ESOL)
-9.46
Class (ESOL)
Insoluble
Log S (Ali)
-11.42
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.61
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)
-3.28

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
3

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