2-{[(naphthalen-1-yl)methyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(naphthalen-1-yl)methyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
2-{[(naphthalen-1-yl)methyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | D365-0137 |
| Compound Name: | 2-{[(naphthalen-1-yl)methyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one |
| Molecular Weight: | 322.43 |
| Molecular Formula: | C19 H18 N2 O S |
| Smiles: | C1CCC2=C(C1)C(NC(=N2)SCc1cccc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9897 |
| logD: | 3.8595 |
| logSw: | -4.2079 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.2 |
| InChI Key: | ZBNPVXGNGFGIMI-UHFFFAOYSA-N |