2-[(3-phenylpropyl)sulfanyl]-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Chemical Structure Depiction of
2-[(3-phenylpropyl)sulfanyl]-5,6,7,8-tetrahydroquinazolin-4(3H)-one
2-[(3-phenylpropyl)sulfanyl]-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | D467-0105 |
| Compound Name: | 2-[(3-phenylpropyl)sulfanyl]-5,6,7,8-tetrahydroquinazolin-4(3H)-one |
| Molecular Weight: | 300.42 |
| Molecular Formula: | C17 H20 N2 O S |
| Smiles: | C1CCC2=C(C1)C(NC(=N2)SCCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9682 |
| logD: | 3.7469 |
| logSw: | -4.1836 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.472 |
| InChI Key: | MLADDUDOSRRBCT-UHFFFAOYSA-N |