2-(benzylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Chemical Structure Depiction of
2-(benzylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
2-(benzylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Compound characteristics
| Compound ID: | 4209-0004 |
| Compound Name: | 2-(benzylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one |
| Molecular Weight: | 374.5 |
| Molecular Formula: | C23 H22 N2 O S |
| Smiles: | C1CCC2(C1)Cc1ccccc1C1=C2C(NC(=N1)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5286 |
| logD: | 4.4951 |
| logSw: | -4.5034 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.645 |
| InChI Key: | RVKNNZBAEJTCSR-UHFFFAOYSA-N |