Compound Structure

Ritonavir

CAS Number: 155213-67-5

Molecular Mass: 720.95 g/mol

Formula: C37H48N6O5S2

Smiles: O=C(OCC=1SC=NC1)NC(CC=2C=CC=CC2)C(O)CC(NC(=O)C(NC(=O)N(C)CC=3N=C(SC3)C(C)C)C(C)C)CC=4C=CC=CC4

Synonymes: Ritonavir, 2,7,10,12-Tetraazatridecanoic acid, 4-hydroxy-12-methyl-9-(1-methylethyl)-13-[2-(1-methylethyl)-4-thiazolyl]-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S,4S,6S,9S)-, 2,4,7,12-Tetraazatridecan-13-oic acid, 10-hydroxy-2-methyl-5-(1-methylethyl)-1-[2-(1-methylethyl)-4-thiazolyl]-3,6-dioxo-8,11-bis(phenylmethyl)-, 5-thiazolylmethyl ester, [5S-(5R*,8R*,10R*,11R*)]-, 2,4,7,12-Tetraazatridecan-13-oic acid, 10-hydroxy-2-methyl-5-(1-methylethyl)-1-[2-(1-methylethyl)-4-thiazolyl]-3,6-dioxo-8,11-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (5S,8S,10S,11S)-, ABT 538, Abbott 84538, Ritonavir, A 84538, Norvir, NSC 693184, RTV, Ritomune, Viriton, Ritovir, Empetus, Novir, MeSH ID: D019438, Ritonavir (p4503A4 inhibitor)

Bioactivity: -

Solubility in Different Solvents

Solvent Temperature [K] Crystal form Solubility [mg/mL] Reference
Cyclohexane 298.0 Amorphous 0.0019 None
Acetonitrile 298.0 Amorphous 4.97? None

Thermodynamic parameters of solution

Solvent Temperature [K] Crystal form ΔHsol [kJ/mol] ΔSsol [J/mol/K] ΔGsol [kJ/mol] Reference
Cyclohexane 298.0 Amorphous - - 31.8 -
Acetonitrile 298.0 Amorphous - - 12.3 -