5-amino-4-(1,3-benzothiazol-2-yl)-1-(3,4-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
Chemical Structure Depiction of
5-amino-4-(1,3-benzothiazol-2-yl)-1-(3,4-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
5-amino-4-(1,3-benzothiazol-2-yl)-1-(3,4-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one
Compound characteristics
| Compound ID: | G820-0011 |
| Compound Name: | 5-amino-4-(1,3-benzothiazol-2-yl)-1-(3,4-dimethoxyphenyl)-1,2-dihydro-3H-pyrrol-3-one |
| Molecular Weight: | 367.42 |
| Molecular Formula: | C19 H17 N3 O3 S |
| Smiles: | COc1ccc(cc1OC)N1CC(C(=C1N)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9533 |
| logD: | 2.9533 |
| logSw: | -3.2724 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.681 |
| InChI Key: | ZDSHWWRXXZEVJF-UHFFFAOYSA-N |