N-[(furan-2-yl)methyl]-2-{[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-2-{[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide
N-[(furan-2-yl)methyl]-2-{[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F367-0226 |
| Compound Name: | N-[(furan-2-yl)methyl]-2-{[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide |
| Molecular Weight: | 459.53 |
| Molecular Formula: | C24 H21 N5 O3 S |
| Smiles: | C(CN1C(c2ccccc2n2c1nnc2SCC(NCc1ccco1)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.426 |
| logD: | 3.426 |
| logSw: | -3.8759 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.511 |
| InChI Key: | XWWPGFWGILBDOE-UHFFFAOYSA-N |