3-{1-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-(2-methylpropyl)propanamide
Chemical Structure Depiction of
3-{1-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-(2-methylpropyl)propanamide
3-{1-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-(2-methylpropyl)propanamide
Compound characteristics
| Compound ID: | L942-0141 |
| Compound Name: | 3-{1-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-(2-methylpropyl)propanamide |
| Molecular Weight: | 482.56 |
| Molecular Formula: | C23 H26 N6 O4 S |
| Smiles: | CC(C)CNC(CCN1C(c2ccccc2n2c1nnc2SCC(NCc1ccco1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9597 |
| logD: | 1.9597 |
| logSw: | -2.6383 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.254 |
| InChI Key: | LXISGRWUZNIBRH-UHFFFAOYSA-N |