ethyl [(4-oxo-3-phenyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(4-oxo-3-phenyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]acetate
ethyl [(4-oxo-3-phenyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 2858-0159 |
| Compound Name: | ethyl [(4-oxo-3-phenyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]acetate |
| Molecular Weight: | 446.57 |
| Molecular Formula: | C26 H26 N2 O3 S |
| Smiles: | CCOC(CSC1=NC2=C(C(N1c1ccccc1)=O)C1(CCCC1)Cc1ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8651 |
| logD: | 4.8481 |
| logSw: | -4.5952 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.734 |
| InChI Key: | CBIUWHWQKCFSTP-UHFFFAOYSA-N |