N-benzyl-2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-N-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-benzyl-2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-N-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxamide
N-benzyl-2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-N-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G859-0324 |
| Compound Name: | N-benzyl-2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-N-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 547.68 |
| Molecular Formula: | C33 H29 N3 O3 S |
| Smiles: | CN(Cc1ccccc1)C(c1ccc2C(N(C(=Nc2c1)SCc1ccc(C=C)cc1)c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6141 |
| logD: | 5.614 |
| logSw: | -5.453 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.854 |
| InChI Key: | UPWSARRVGZFRMS-UHFFFAOYSA-N |