3-benzyl-2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-N-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-benzyl-2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-N-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
3-benzyl-2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-N-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-1092 |
| Compound Name: | 3-benzyl-2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-N-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 537.64 |
| Molecular Formula: | C31 H27 N3 O4 S |
| Smiles: | Cc1ccc(C(CSC2=Nc3cc(ccc3C(N2Cc2ccccc2)=O)C(NCc2ccco2)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.9808 |
| logD: | 5.9807 |
| logSw: | -5.4182 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.18 |
| InChI Key: | UBGQSIVLPHJPSL-UHFFFAOYSA-N |