4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-5-(3-methoxyphenyl)-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-5-(3-methoxyphenyl)-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one
4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-5-(3-methoxyphenyl)-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
Compound ID: | Y070-1488 |
Compound Name: | 4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-5-(3-methoxyphenyl)-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one |
Molecular Weight: | 439.46 |
Molecular Formula: | C24 H25 N O7 |
Smiles: | COCCCN1C(C(=C(C1=O)O)C(c1ccc2c(c1)OCCO2)=O)c1cccc(c1)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 1.9967 |
logD: | 1.9956 |
logSw: | -2.4283 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.786 |
InChI Key: | SGEAMLWTVLFEAV-NRFANRHFSA-N |