3-{4-[(4-methylphenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-{3-[(propan-2-yl)oxy]propyl}propanamide
Chemical Structure Depiction of
3-{4-[(4-methylphenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-{3-[(propan-2-yl)oxy]propyl}propanamide
3-{4-[(4-methylphenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-{3-[(propan-2-yl)oxy]propyl}propanamide
Compound characteristics
| Compound ID: | C741-0138 |
| Compound Name: | 3-{4-[(4-methylphenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-{3-[(propan-2-yl)oxy]propyl}propanamide |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C26 H31 N5 O3 |
| Smiles: | CC(C)OCCCNC(CCc1nnc2N(Cc3ccc(C)cc3)C(c3ccccc3n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3303 |
| logD: | 2.3303 |
| logSw: | -3.0035 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.492 |
| InChI Key: | AXHSZNSRVLGVOR-UHFFFAOYSA-N |