N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F943-1254 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 491.54 |
| Molecular Formula: | C21 H21 N3 O7 S2 |
| Smiles: | C(c1ccc2c(c1)OCO2)NS(c1ccc2c(c1)SC(N2CC(N1CCOCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.93 |
| logD: | 1.9299 |
| logSw: | -2.8552 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.986 |
| InChI Key: | WUWVONNCKLOISD-UHFFFAOYSA-N |