4-(2H-1,3-benzodioxole-5-carbonyl)-3-hydroxy-5-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-(2H-1,3-benzodioxole-5-carbonyl)-3-hydroxy-5-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
4-(2H-1,3-benzodioxole-5-carbonyl)-3-hydroxy-5-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 8020-7240 |
| Compound Name: | 4-(2H-1,3-benzodioxole-5-carbonyl)-3-hydroxy-5-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 510.5 |
| Molecular Formula: | C26 H26 N2 O9 |
| Smiles: | COc1cc(cc2c1OCO2)C1C(=C(C(N1CCN1CCOCC1)=O)O)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1643 |
| logD: | 2.1493 |
| logSw: | -2.8466 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.242 |
| InChI Key: | NVFXIMYCWXAHDK-QFIPXVFZSA-N |