3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
Compound ID: | F067-0023 |
Compound Name: | 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-N-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
Molecular Weight: | 522.02 |
Molecular Formula: | C27 H24 Cl N3 O4 S |
Smiles: | COCCNC(c1ccc2C(N(Cc3ccccc3)C(=Nc2c1)SCC(c1ccc(cc1)[Cl])=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1982 |
logD: | 4.1982 |
logSw: | -4.6293 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.887 |
InChI Key: | ZNUBLIAVBGVEJY-UHFFFAOYSA-N |