4-(2,3-dihydro-1,4-benzodioxine-6-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-(2,3-dihydro-1,4-benzodioxine-6-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-(2,3-dihydro-1,4-benzodioxine-6-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: | 8020-7408 |
| Compound Name: | 4-(2,3-dihydro-1,4-benzodioxine-6-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: | 524.53 |
| Molecular Formula: | C27 H28 N2 O9 |
| Smiles: | COc1cc(cc2c1OCO2)C1C(=C(C(N1CCN1CCOCC1)=O)O)C(c1ccc2c(c1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3038 |
| logD: | 1.2888 |
| logSw: | -2.2905 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.95 |
| InChI Key: | KNPCJZLGYJICKK-QHCPKHFHSA-N |