N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide
Compound characteristics
| Compound ID: | C741-0808 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-3-[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide |
| Molecular Weight: | 536.68 |
| Molecular Formula: | C32 H36 N6 O2 |
| Smiles: | CCN(CCCNC(CCc1nnc2N(CCc3ccccc3)C(c3ccccc3n12)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9885 |
| logD: | 3.9562 |
| logSw: | -4.1635 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.988 |
| InChI Key: | WIXNUDKVJPHJIJ-UHFFFAOYSA-N |