5-amino-4-(1,3-benzothiazol-2-yl)-1-(1-phenylethyl)-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1,3-benzothiazol-2-yl)-1-(1-phenylethyl)-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1,3-benzothiazol-2-yl)-1-(1-phenylethyl)-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | D086-0276 |
| Compound Name: | 5-amino-4-(1,3-benzothiazol-2-yl)-1-(1-phenylethyl)-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 335.43 |
| Molecular Formula: | C19 H17 N3 O S |
| Smiles: | CC(c1ccccc1)N1CC(C(=C1N)c1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7435 |
| logD: | 3.7435 |
| logSw: | -4.0887 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.372 |
| InChI Key: | ZOFFJBGAOFKFSD-LBPRGKRZSA-N |