N-[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1,3-thiazol-2-yl]-2-methylbenzamide
Chemical Structure Depiction of
N-[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1,3-thiazol-2-yl]-2-methylbenzamide
N-[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1,3-thiazol-2-yl]-2-methylbenzamide
Compound characteristics
| Compound ID: | V028-6092 |
| Compound Name: | N-[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1,3-thiazol-2-yl]-2-methylbenzamide |
| Molecular Weight: | 377.46 |
| Molecular Formula: | C21 H19 N3 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1C(Nc1nc(cs1)C(N1CCc2ccccc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1765 |
| logD: | 4.0174 |
| logSw: | -4.1427 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.686 |
| InChI Key: | KEURNEAEBHNTBL-UHFFFAOYSA-N |