N-{[4-(dimethylamino)phenyl]methyl}-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-{[4-(dimethylamino)phenyl]methyl}-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F943-1465 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 490.6 |
| Molecular Formula: | C22 H26 N4 O5 S2 |
| Smiles: | CN(C)c1ccc(CNS(c2ccc3c(c2)SC(N3CC(N2CCOCC2)=O)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1069 |
| logD: | 2.0963 |
| logSw: | -3.0366 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.675 |
| InChI Key: | STTHEEPTAOFBDV-UHFFFAOYSA-N |