7-(3,4-diethoxyphenyl)-3-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
7-(3,4-diethoxyphenyl)-3-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}thieno[3,2-d]pyrimidin-4(3H)-one
7-(3,4-diethoxyphenyl)-3-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | L115-0389 |
Compound Name: | 7-(3,4-diethoxyphenyl)-3-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}thieno[3,2-d]pyrimidin-4(3H)-one |
Molecular Weight: | 489.59 |
Molecular Formula: | C27 H27 N3 O4 S |
Smiles: | CCOc1ccc(cc1OCC)c1csc2C(N(Cc3ccc(cc3)N3CCCC3=O)C=Nc12)=O |
Stereo: | ACHIRAL |
logP: | 3.8293 |
logD: | 3.8293 |
logSw: | -4.0076 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 56.071 |
InChI Key: | QXVCPVNMKZKEIV-UHFFFAOYSA-N |