5-amino-4-(1,3-benzothiazol-2-yl)-1-{2-[benzyl(methyl)amino]ethyl}-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1,3-benzothiazol-2-yl)-1-{2-[benzyl(methyl)amino]ethyl}-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1,3-benzothiazol-2-yl)-1-{2-[benzyl(methyl)amino]ethyl}-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | F187-0205 |
| Compound Name: | 5-amino-4-(1,3-benzothiazol-2-yl)-1-{2-[benzyl(methyl)amino]ethyl}-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C21 H22 N4 O S |
| Smiles: | CN(CCN1CC(C(=C1N)c1nc2ccccc2s1)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0871 |
| logD: | 1.4513 |
| logSw: | -3.213 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.938 |
| InChI Key: | WUCHEWWGUWKRBR-UHFFFAOYSA-N |