5-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-(thiophene-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-(thiophene-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one
5-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-(thiophene-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 8020-7373 |
| Compound Name: | 5-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-(thiophene-2-carbonyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 497.53 |
| Molecular Formula: | C24 H23 N3 O7 S |
| Smiles: | COc1c(cc2c(c1OC)OCO2)C1C(=C(C(N1CCCn1ccnc1)=O)O)C(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.14 |
| logD: | 1.8895 |
| logSw: | -2.7796 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.858 |
| InChI Key: | FDKPTVKJABCJEM-GOSISDBHSA-N |