2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N-phenylacetamide
Chemical Structure Depiction of
2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N-phenylacetamide
2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N-phenylacetamide
Compound characteristics
| Compound ID: | D325-0702 |
| Compound Name: | 2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N-phenylacetamide |
| Molecular Weight: | 459.61 |
| Molecular Formula: | C27 H29 N3 O2 S |
| Smiles: | CCCN1C(=NC2=C(C1=O)C1(CCCC1)Cc1ccccc12)SCC(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.253 |
| logD: | 5.253 |
| logSw: | -4.9545 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.314 |
| InChI Key: | BIOOBIYSMMYRLH-UHFFFAOYSA-N |