N-benzyl-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}acetamide
N-benzyl-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L112-0738 |
| Compound Name: | N-benzyl-2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 440.57 |
| Molecular Formula: | C26 H24 N4 O S |
| Smiles: | C1CN(Cc2ccccc12)c1nc(c2ccccc2n1)SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5739 |
| logD: | 5.5696 |
| logSw: | -6.0141 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.897 |
| InChI Key: | GBJYRZWDOTWGHU-UHFFFAOYSA-N |