2-[(3-methoxyphenyl)methyl]-1,5-dioxo-N-(propan-2-yl)-4-propyl-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
2-[(3-methoxyphenyl)methyl]-1,5-dioxo-N-(propan-2-yl)-4-propyl-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
2-[(3-methoxyphenyl)methyl]-1,5-dioxo-N-(propan-2-yl)-4-propyl-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | F471-0031 |
| Compound Name: | 2-[(3-methoxyphenyl)methyl]-1,5-dioxo-N-(propan-2-yl)-4-propyl-1,2,4,5-tetrahydro[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C24 H27 N5 O4 |
| Smiles: | CCCN1C2=NN(Cc3cccc(c3)OC)C(N2c2cc(ccc2C1=O)C(NC(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0426 |
| logD: | 3.0426 |
| logSw: | -3.4597 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.388 |
| InChI Key: | CTKVCNPVKARCSY-UHFFFAOYSA-N |