2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide
2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide
Compound characteristics
Compound ID: | L112-0744 |
Compound Name: | 2-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)quinazolin-4-yl]sulfanyl}-N-[(4-fluorophenyl)methyl]acetamide |
Molecular Weight: | 458.56 |
Molecular Formula: | C26 H23 F N4 O S |
Smiles: | C1CN(Cc2ccccc12)c1nc(c2ccccc2n1)SCC(NCc1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 5.603 |
logD: | 5.5987 |
logSw: | -6.0133 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 44.897 |
InChI Key: | WPZUUCZYJCXYGV-UHFFFAOYSA-N |