N-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,3,4-thiadiazol-2-yl]propanamide
Chemical Structure Depiction of
N-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,3,4-thiadiazol-2-yl]propanamide
N-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,3,4-thiadiazol-2-yl]propanamide
Compound characteristics
| Compound ID: | Y300-3574 |
| Compound Name: | N-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,3,4-thiadiazol-2-yl]propanamide |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C14 H16 N4 O3 S2 |
| Smiles: | CCC(Nc1nnc(s1)S(N1CCc2ccccc2C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5104 |
| logD: | 2.1601 |
| logSw: | -2.8359 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.08 |
| InChI Key: | JZCCZZDKVDUPDH-UHFFFAOYSA-N |