CAS RN: 28978-09-8

(Dimethylphenylphosphine)gold chloride

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  • Product code: starshine_CAS28978-09-8
  • Purity/Analytical Methods: >99.0%
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28978-09-8 / chlorogold;dimethyl(phenyl)phosphane

Standard CAS: 28978-09-8 Multi CAS: Yes

Basic Information

CAS
28978-09-8
Multi CAS
Yes
Molecular Formula
C8H11AUCLP
Molecular Weight
370.560000
Exact Mass
369.995260
InChI
InChI=1S/C8H11P.Au.ClH/c1-9(2)8-6-4-3-5-7-8;;/h3-7H,1-2H3;;1H/q;+1;/p-1
InChIKey
JUNOUWMLMVXRDI-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
1
Molar refractivity
50.7
TPSA
0.0000

LogP / Solubility

WLOGP
2.74
MLOGP
2.43
XLogP3
2.74
Consensus LogP
2.64
Log S (ESOL)
-4.2
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.58
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.46
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.03

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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