![CAS 15283-45-1 trisodium bis[thiosulphato(2-)-O,S]aurate(3-) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/15283-45-1.gif)
CAS RN: 15283-45-1
trisodium bis[thiosulphato(2-)-O,S]aurate(3-)
Product Availability
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3 package records3 with current stock1 grade group
- Product code: starshine_CAS15283-45-1
- Purity/Analytical Methods: >99.0%
15283-45-1 / trisodium;gold;bis(hydroxy-oxido-oxo-sulfanylidene-lambda6-sulfane)
Basic Information
CAS
15283-45-1
Multi CAS
No
Molecular Formula
AuH2Na3O6S4+
Molecular Weight
492.200000
Exact Mass
491.809300
SMILES
OS(=O)(=S)[O-].OS(=O)(=S)[O-].[Na+].[Na+].[Na+].[Au]
InChI
InChI=1S/Au.3Na.2H2O3S2/c;;;;2*1-5(2,3)4/h;;;;2*(H2,1,2,3,4)/q;3*+1;;/p-2
InChIKey
UCGZDNYYMDPSRK-UHFFFAOYSA-L
Computed Properties
Structural Parameters
Heavy atom count
14
H-bond acceptors
6
H-bond donors
2
Molar refractivity
37.83
TPSA
120.72
LogP / Solubility
WLOGP
-10.32
MLOGP
-9.05
XLogP3
-10.32
Consensus LogP
-9.9
Log S (ESOL)
3.61
Class (ESOL)
Highly soluble
Log S (Ali)
3.85
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
5.7
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-13.05
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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