3-[3-oxo-3-(piperidin-1-yl)propyl]-6-(4-propylpiperazine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-[3-oxo-3-(piperidin-1-yl)propyl]-6-(4-propylpiperazine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one
3-[3-oxo-3-(piperidin-1-yl)propyl]-6-(4-propylpiperazine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F952-0517 |
| Compound Name: | 3-[3-oxo-3-(piperidin-1-yl)propyl]-6-(4-propylpiperazine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 480.65 |
| Molecular Formula: | C22 H32 N4 O4 S2 |
| Smiles: | CCCN1CCN(CC1)S(c1ccc2c(c1)SC(N2CCC(N1CCCCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7006 |
| logD: | 2.6104 |
| logSw: | -3.2072 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 67.684 |
| InChI Key: | TWJSAVMFXIMZRO-UHFFFAOYSA-N |