2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | D467-0097 |
| Compound Name: | 2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one |
| Molecular Weight: | 316.42 |
| Molecular Formula: | C17 H20 N2 O2 S |
| Smiles: | Cc1cccc(c1)OCCSC1NC(C2CCCCC=2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3481 |
| logD: | 3.1268 |
| logSw: | -3.5106 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.89 |
| InChI Key: | FABHNAZKAZKENG-UHFFFAOYSA-N |