6-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)hexanamide
Chemical Structure Depiction of
6-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)hexanamide
6-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)hexanamide
Compound characteristics
| Compound ID: | 6455-0036 |
| Compound Name: | 6-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)hexanamide |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C20 H26 N4 O3 S |
| Smiles: | CCCc1nnc(NC(CCCCCN2C(C3C4CC(C=C4)C3C2=O)=O)=O)s1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3725 |
| logD: | 2.2868 |
| logSw: | -2.7362 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.504 |
| InChI Key: | YEKNWNRRHMKECF-UHFFFAOYSA-N |