methyl [(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
methyl [(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
methyl [(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 3497-0027 |
| Compound Name: | methyl [(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 326.37 |
| Molecular Formula: | C17 H14 N2 O3 S |
| Smiles: | COC(CSC1=Nc2ccccc2C(N1c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0727 |
| logD: | 2.0726 |
| logSw: | -2.7796 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.01 |
| InChI Key: | QBKFJJSNKWKRRJ-UHFFFAOYSA-N |