N-(butan-2-yl)-3-(3-methylphenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
N-(butan-2-yl)-3-(3-methylphenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
N-(butan-2-yl)-3-(3-methylphenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E543-0232 |
| Compound Name: | N-(butan-2-yl)-3-(3-methylphenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide |
| Molecular Weight: | 375.43 |
| Molecular Formula: | C21 H21 N5 O2 |
| Smiles: | CCC(C)NC(c1ccc2C(Nc3c(c4cccc(C)c4)nnn3c2c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7227 |
| logD: | 2.7226 |
| logSw: | -3.221 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.357 |
| InChI Key: | KGRRGGSQKABBAF-ZDUSSCGKSA-N |