2-(3-methoxypropyl)-1,3-dioxo-N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-isoindole-5-carboxamide
Chemical Structure Depiction of
2-(3-methoxypropyl)-1,3-dioxo-N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-isoindole-5-carboxamide
2-(3-methoxypropyl)-1,3-dioxo-N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-isoindole-5-carboxamide
Compound characteristics
Compound ID: | Y042-3689 |
Compound Name: | 2-(3-methoxypropyl)-1,3-dioxo-N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1H-isoindole-5-carboxamide |
Molecular Weight: | 416.45 |
Molecular Formula: | C19 H20 N4 O5 S |
Smiles: | COCCCN1C(c2ccc(cc2C1=O)C(Nc1nnc(C2CCCO2)s1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.765 |
logD: | 0.051 |
logSw: | -2.7062 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 92.86 |
InChI Key: | JFTQESBTHWSJFW-AWEZNQCLSA-N |