N-[2-{[(4-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[2-{[(4-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-4-methoxybenzamide
N-[2-{[(4-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | K284-4842 |
| Compound Name: | N-[2-{[(4-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-4-methoxybenzamide |
| Molecular Weight: | 435.48 |
| Molecular Formula: | C23 H18 F N3 O3 S |
| Smiles: | COc1ccc(cc1)C(NN1C(=Nc2ccccc2C1=O)SCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9546 |
| logD: | 2.9531 |
| logSw: | -3.6839 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.716 |
| InChI Key: | BSMLQOBIHOCDFS-UHFFFAOYSA-N |