5-amino-4-(1,3-benzothiazol-2-yl)-1-[4-(piperidin-1-yl)phenyl]-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1,3-benzothiazol-2-yl)-1-[4-(piperidin-1-yl)phenyl]-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1,3-benzothiazol-2-yl)-1-[4-(piperidin-1-yl)phenyl]-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | D086-0290 |
| Compound Name: | 5-amino-4-(1,3-benzothiazol-2-yl)-1-[4-(piperidin-1-yl)phenyl]-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 390.51 |
| Molecular Formula: | C22 H22 N4 O S |
| Smiles: | C1CCN(CC1)c1ccc(cc1)N1CC(C(=C1N)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1983 |
| logD: | 4.1943 |
| logSw: | -4.2669 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.872 |
| InChI Key: | GBKJBZUMOUKSSZ-UHFFFAOYSA-N |