2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N,N-dipropylacetamide
Chemical Structure Depiction of
2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N,N-dipropylacetamide
2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N,N-dipropylacetamide
Compound characteristics
| Compound ID: | 8016-0588 |
| Compound Name: | 2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N,N-dipropylacetamide |
| Molecular Weight: | 529.75 |
| Molecular Formula: | C32 H39 N3 O2 S |
| Smiles: | CCCN(CCC)C(CSC1=NC2=C(C(N1Cc1ccccc1)=O)C1(CCCCC1)Cc1ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7376 |
| logD: | 6.7373 |
| logSw: | -5.5872 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.733 |
| InChI Key: | SFYBSMYAJRDBKU-UHFFFAOYSA-N |