2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N,N-diethylacetamide
Chemical Structure Depiction of
2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N,N-diethylacetamide
2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N,N-diethylacetamide
Compound characteristics
| Compound ID: | 6150-0005 |
| Compound Name: | 2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)sulfanyl]-N,N-diethylacetamide |
| Molecular Weight: | 487.66 |
| Molecular Formula: | C29 H33 N3 O2 S |
| Smiles: | CCN(CC)C(CSC1=NC2=C(C(N1Cc1ccccc1)=O)C1(CCCC1)Cc1ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4008 |
| logD: | 5.4007 |
| logSw: | -5.2439 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.591 |
| InChI Key: | DBBPBDVAQGOGEJ-UHFFFAOYSA-N |