N-[2-(azepan-1-yl)ethyl]-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-[2-(azepan-1-yl)ethyl]-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F943-1432 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 482.62 |
| Molecular Formula: | C21 H30 N4 O5 S2 |
| Smiles: | C1CCCN(CC1)CCNS(c1ccc2c(c1)SC(N2CC(N1CCOCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8845 |
| logD: | 1.1243 |
| logSw: | -2.7877 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.026 |
| InChI Key: | PIUIUIYBOADVFW-UHFFFAOYSA-N |