1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}ethan-1-one
1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | D692-0473 |
| Compound Name: | 1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[5-(furan-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 441.51 |
| Molecular Formula: | C24 H19 N5 O2 S |
| Smiles: | C1Cc2ccccc2N(C1)C(CSc1nnc2c3ccccc3nc(c3ccco3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2437 |
| logD: | 4.2437 |
| logSw: | -4.2839 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.946 |
| InChI Key: | TVJQYPXZYAZNNX-UHFFFAOYSA-N |