2-{[3-(4-chlorophenoxy)propyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[3-(4-chlorophenoxy)propyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
2-{[3-(4-chlorophenoxy)propyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | D467-0102 |
| Compound Name: | 2-{[3-(4-chlorophenoxy)propyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one |
| Molecular Weight: | 350.87 |
| Molecular Formula: | C17 H19 Cl N2 O2 S |
| Smiles: | C1CCC2=C(C1)C(NC(=N2)SCCCOc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0241 |
| logD: | 3.8027 |
| logSw: | -4.4884 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.89 |
| InChI Key: | DYRSKTFXPBCRNY-UHFFFAOYSA-N |