N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-(3-phenylpropyl)-2,3-dihydro-1H-isoindole-5-carboxamide
Chemical Structure Depiction of
N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-(3-phenylpropyl)-2,3-dihydro-1H-isoindole-5-carboxamide
N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-(3-phenylpropyl)-2,3-dihydro-1H-isoindole-5-carboxamide
Compound characteristics
| Compound ID: | Y042-3696 |
| Compound Name: | N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-2-(3-phenylpropyl)-2,3-dihydro-1H-isoindole-5-carboxamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C21 H18 N4 O3 S |
| Smiles: | Cc1nnc(NC(c2ccc3C(N(CCCc4ccccc4)C(c3c2)=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.534 |
| logD: | 1.7998 |
| logSw: | -3.7999 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.912 |
| InChI Key: | RUQWUKKLELQLRI-UHFFFAOYSA-N |