5-amino-1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(1,3-benzothiazol-2-yl)-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(1,3-benzothiazol-2-yl)-1,2-dihydro-3H-pyrrol-3-one
5-amino-1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(1,3-benzothiazol-2-yl)-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | F187-0065 |
| Compound Name: | 5-amino-1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(1,3-benzothiazol-2-yl)-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 365.41 |
| Molecular Formula: | C19 H15 N3 O3 S |
| Smiles: | C1C(C(=C(N)N1Cc1ccc2c(c1)OCO2)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9786 |
| logD: | 2.9786 |
| logSw: | -3.1982 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.981 |
| InChI Key: | UIEOJAHGFPHYBQ-UHFFFAOYSA-N |