N-benzyl-2-({3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-benzyl-2-({3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide
N-benzyl-2-({3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
Compound ID: | C764-0425 |
Compound Name: | N-benzyl-2-({3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide |
Molecular Weight: | 485.56 |
Molecular Formula: | C27 H23 N3 O4 S |
Smiles: | COc1ccc(CN2C(=Nc3c4ccccc4oc3C2=O)SCC(NCc2ccccc2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.902 |
logD: | 4.902 |
logSw: | -4.7956 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.682 |
InChI Key: | SVEQRGDSGRDBAB-UHFFFAOYSA-N |