5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-phenylpropyl)-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-phenylpropyl)-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-phenylpropyl)-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | F187-0112 |
| Compound Name: | 5-amino-4-(1,3-benzothiazol-2-yl)-1-(2-phenylpropyl)-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 349.45 |
| Molecular Formula: | C20 H19 N3 O S |
| Smiles: | CC(CN1CC(C(=C1N)c1nc2ccccc2s1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2625 |
| logD: | 4.2625 |
| logSw: | -4.3393 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.865 |
| InChI Key: | NCFBPAVKZITMDL-ZDUSSCGKSA-N |