3-benzyl-2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-benzyl-2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide
3-benzyl-2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
Compound ID: | F067-0009 |
Compound Name: | 3-benzyl-2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide |
Molecular Weight: | 501.6 |
Molecular Formula: | C28 H27 N3 O4 S |
Smiles: | CCCNC(c1ccc2C(N(Cc3ccccc3)C(=Nc2c1)SCC(c1ccc(cc1)OC)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.3188 |
logD: | 4.3188 |
logSw: | -4.2901 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.088 |
InChI Key: | IBKCBOCUKSJSBT-UHFFFAOYSA-N |