ethyl 4-({3-[(2-methoxyphenyl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-3-oxobutanoate
Chemical Structure Depiction of
ethyl 4-({3-[(2-methoxyphenyl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-3-oxobutanoate
ethyl 4-({3-[(2-methoxyphenyl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-3-oxobutanoate
Compound characteristics
Compound ID: | K284-0589 |
Compound Name: | ethyl 4-({3-[(2-methoxyphenyl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)-3-oxobutanoate |
Molecular Weight: | 426.49 |
Molecular Formula: | C22 H22 N2 O5 S |
Smiles: | CCOC(CC(CSC1=Nc2ccccc2C(N1Cc1ccccc1OC)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.9159 |
logD: | 2.9158 |
logSw: | -3.5384 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 66.587 |
InChI Key: | ZUVMRJQYHBWJRU-UHFFFAOYSA-N |