Rosiglitazone

Compound Structure

CAS Number: 122320-73-4

Molecular Mass: 357.4 g/mol

Formula: C18H19N3O3S

Smiles: CN(CCOc1ccc(CC2SC(=O)NC2=O)cc1)c1ccccn1

Synonymes:

Bioactivity: -

Solubility in Different Solvents

Solvent Temperature [K] Crystal form Solubility [mg/mL] Reference
1-Butanol 283.15 - 1.346 [307]
1-Butanol 293.15 - 1.451 [307]
1-Butanol 303.15 - 1.62 [307]
1-Butanol 313.15 - 2.415 [307]
1-Butanol 323.15 - 5.568 [307]
1-Butanol 333.15 - 11.06 [307]
1-Propanol 283.15 - 1.333 [307]
1-Propanol 293.15 - 1.339 [307]
1-Propanol 303.15 - 1.528 [307]
1-Propanol 313.15 - 3.471 [307]
1-Propanol 323.15 - 6.176 [307]
1-Propanol 333.15 - 13.35 [307]
Acetone 283.15 - 8.772 [307]
Acetone 293.15 - 13.57 [307]
Acetone 303.15 - 21.92 [307]
Acetone 313.15 - 32.87 [307]
Acetone 323.15 - 46.62 [307]
Acetonitrile 283.15 - 1.847 [307]
Acetonitrile 293.15 - 3.089 [307]
Acetonitrile 303.15 - 5.0 [307]
Acetonitrile 313.15 - 8.361 [307]
Acetonitrile 323.15 - 10.87 [307]
Acetonitrile 333.15 - 22.73 [307]
Butyl acetate 283.15 - 2.539 [307]
Butyl acetate 293.15 - 3.169 [307]
Butyl acetate 303.15 - 6.312 [307]
Butyl acetate 313.15 - 9.445 [307]
Butyl acetate 323.15 - 13.32 [307]
Butyl acetate 333.15 - 24.08 [307]
Ethanol 283.15 - 1.516 [307]
Ethanol 293.15 - 2.089 [307]
Ethanol 303.15 - 2.775 [307]
Ethanol 313.15 - 4.02 [307]
Ethanol 323.15 - 7.339 [307]
Ethanol 333.15 - 14.33 [307]
Ethyl acetate 283.15 - 4.555 [307]
Ethyl acetate 293.15 - 7.502 [307]
Ethyl acetate 303.15 - 10.83 [307]
Ethyl acetate 313.15 - 15.73 [307]
Ethyl acetate 323.15 - 22.87 [307]
Ethyl acetate 333.15 - 41.17 [307]
Isopropanol 283.15 - 0.6161 [307]
Isopropanol 293.15 - 0.8089 [307]
Isopropanol 303.15 - 1.306 [307]
Isopropanol 313.15 - 2.417 [307]
Isopropanol 323.15 - 4.486 [307]
Isopropanol 333.15 - 9.752 [307]
Methanol 283.15 - 1.237 [307]
Methanol 293.15 - 1.618 [307]
Methanol 303.15 - 3.872 [307]
Methanol 313.15 - 6.423 [307]
Methanol 323.15 - 11.25 [307]
Methanol 333.15 - 19.83 [307]
Methyl acetate 283.15 - 5.609 [307]
Methyl acetate 293.15 - 9.251 [307]
Methyl acetate 303.15 - 14.95 [307]
Methyl acetate 313.15 - 22.91 [307]
Methyl acetate 323.15 - 34.59 [307]
Methyl acetate 333.15 - 54.26 [307]

Molecule 3D descriptors

Descriptor Value
PMI1 1167.1906
PMI2 8219.6274
PMI3 8514.3419
NPR1 0.1371
NPR2 0.9654
RadiusOfGyration 5.0041
InertialShapeFactor 0.0008
Eccentricity 0.9906
Asphericity 0.6479
SpherocityIndex 0.1857
PBF 1.0365