N-[6-(2-oxo-2-{3-[(pyrrolidin-1-yl)methyl]anilino}ethyl)-1,3-benzothiazol-2-yl]propanamide
Chemical Structure Depiction of
N-[6-(2-oxo-2-{3-[(pyrrolidin-1-yl)methyl]anilino}ethyl)-1,3-benzothiazol-2-yl]propanamide
N-[6-(2-oxo-2-{3-[(pyrrolidin-1-yl)methyl]anilino}ethyl)-1,3-benzothiazol-2-yl]propanamide
Compound characteristics
| Compound ID: | F223-0883 |
| Compound Name: | N-[6-(2-oxo-2-{3-[(pyrrolidin-1-yl)methyl]anilino}ethyl)-1,3-benzothiazol-2-yl]propanamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C23 H26 N4 O2 S |
| Smiles: | CCC(Nc1nc2ccc(CC(Nc3cccc(CN4CCCC4)c3)=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4377 |
| logD: | 0.5895 |
| logSw: | -3.6847 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.125 |
| InChI Key: | BZXXDLWHTCEGGQ-UHFFFAOYSA-N |