N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(8-chloro-5-oxo[1,2,3]triazolo[1,5-a]quinazolin-4(5H)-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(8-chloro-5-oxo[1,2,3]triazolo[1,5-a]quinazolin-4(5H)-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(8-chloro-5-oxo[1,2,3]triazolo[1,5-a]quinazolin-4(5H)-yl)acetamide
Compound characteristics
| Compound ID: | C681-0189 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(8-chloro-5-oxo[1,2,3]triazolo[1,5-a]quinazolin-4(5H)-yl)acetamide |
| Molecular Weight: | 411.8 |
| Molecular Formula: | C19 H14 Cl N5 O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1C(c2ccc(cc2n2c1cnn2)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4289 |
| logD: | 2.4289 |
| logSw: | -3.5665 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.661 |
| InChI Key: | JZJUHLLJKHUJRP-UHFFFAOYSA-N |