N-(1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
N-(1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Compound characteristics
| Compound ID: | G786-0418 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide |
| Molecular Weight: | 419.93 |
| Molecular Formula: | C20 H21 N3 O3 S |
| Salt: | HCl |
| Smiles: | CN(C)CCN(C(c1ccc2c(c1)OCCO2)=O)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 2.8184 |
| logD: | 2.5734 |
| logSw: | -3.1511 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.064 |
| InChI Key: | ROYFNOOQWFMDBK-UHFFFAOYSA-N |