4-{2-[(cyanomethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-{2-[(cyanomethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide
4-{2-[(cyanomethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | K284-3531 |
| Compound Name: | 4-{2-[(cyanomethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(furan-2-yl)methyl]butanamide |
| Molecular Weight: | 382.44 |
| Molecular Formula: | C19 H18 N4 O3 S |
| Smiles: | C(CC(NCc1ccco1)=O)CN1C(=Nc2ccccc2C1=O)SCC#N |
| Stereo: | ACHIRAL |
| logP: | 1.3941 |
| logD: | 1.3941 |
| logSw: | -2.2766 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.733 |
| InChI Key: | VETXBYQFOAVOJR-UHFFFAOYSA-N |