CAS RN: 12673-86-8
Shintoron C 4401
Product Availability
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3 package records3 with current stock1 grade group
- Product code: starshine_CAS12673-86-8
- Purity/Analytical Methods: >99.0%
12673-86-8 / tris(tin(4+));tetrastiborate
Basic Information
CAS
12673-86-8
Multi CAS
No
Molecular Formula
O16Sb4Sn3
Molecular Weight
1099.200000
Exact Mass
1101.240700
SMILES
[O-][Sb](=O)([O-])[O-].[O-][Sb](=O)([O-])[O-].[O-][Sb](=O)([O-])[O-].[O-][Sb](=O)([O-])[O-].[Sn+4].[Sn+4].[Sn+4]
InChI
InChI=1S/16O.4Sb.3Sn/q;;;;12*-1;;;;;3*+4
InChIKey
QMDBZZCMDZXBND-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
H-bond acceptors
16
Molar refractivity
43.02
TPSA
345
LogP / Solubility
WLOGP
-17.41
MLOGP
-15.21
XLogP3
-17.41
Consensus LogP
-16.68
Log S (ESOL)
4.31
Class (ESOL)
Highly soluble
Log S (Ali)
4
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
7.64
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)
-21.79
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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