7-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}-3-pentylquinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}-3-pentylquinazoline-2,4(1H,3H)-dione
7-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}-3-pentylquinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | F406-0418 |
| Compound Name: | 7-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}-3-pentylquinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C22 H22 N4 O3 S |
| Smiles: | CCCCCN1C(c2ccc(cc2NC1=O)c1nc(c2ccc(cc2)SC)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1828 |
| logD: | 6.1826 |
| logSw: | -5.3436 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.136 |
| InChI Key: | JQMJNPRYMKTWCC-UHFFFAOYSA-N |