Amlodipine besylate

Compound Structure

CAS Number: 111470-99-6

Molecular Mass: 567.1 g/mol

Formula: C26H31ClN2O8S

Smiles: CCOC(=O)C1=C(COCCN)NC(C)=C(C(=O)OC)C1c1ccccc1Cl.O=S(=O)(O)c1ccccc1

Synonymes:

Bioactivity: -

Solubility in Different Solvents

Solvent Temperature [K] Crystal form Solubility [mg/mL] Reference
Ethanol 293.2 - 16.26 [400]
Ethanol 298.2 - 21.89 [400]
Ethanol 303.2 - 24.67 [400]
Ethanol 308.2 - 27.32 [400]
Ethanol 313.2 - 36.15 [400]
Propylene Glycol 293.2 - 67.17 [400]
Propylene Glycol 298.2 - 77.67 [400]
Propylene Glycol 303.2 - 84.52 [400]
Propylene Glycol 308.2 - 91.26 [400]
Propylene Glycol 313.2 - 97.17 [400]
Water 293.2 - 1.35 [401]
Water 293.2 - 1.1 [400]
Water 298.2 - 1.51 [401]
Water 298.2 - 1.66 [400]
Water 303.2 - 1.97 [401]
Water 303.2 - 1.94 [400]
Water 308.2 - 2.44 [401]
Water 308.2 - 2.529 [400]
Water 313.2 - 3.74 [401]
Water 313.2 - 2.96 [400]

Molecule 3D descriptors

Descriptor Value
PMI1 2577.4040
PMI2 4793.7380
PMI3 5871.9322
NPR1 0.4389
NPR2 0.8164
RadiusOfGyration 3.4172
InertialShapeFactor 0.0003
Eccentricity 0.8985
Asphericity 0.1931
SpherocityIndex 0.3358
PBF 1.0685