2-methyl-1-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-methyl-1-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,2-dihydroisoquinoline-4-carboxamide
2-methyl-1-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y042-4868 |
| Compound Name: | 2-methyl-1-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 339.41 |
| Molecular Formula: | C18 H17 N3 O2 S |
| Smiles: | CN1C=C(C(Nc2nc3CCCCc3s2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.7232 |
| logD: | 0.5522 |
| logSw: | -3.5498 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.746 |
| InChI Key: | MDOUILGCKYVHLQ-UHFFFAOYSA-N |