N-[2-(2,5-dimethoxyphenyl)ethyl]-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-[2-(2,5-dimethoxyphenyl)ethyl]-3-[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide
N-[2-(2,5-dimethoxyphenyl)ethyl]-3-[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide
Compound characteristics
| Compound ID: | C741-0827 |
| Compound Name: | N-[2-(2,5-dimethoxyphenyl)ethyl]-3-[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]propanamide |
| Molecular Weight: | 525.61 |
| Molecular Formula: | C30 H31 N5 O4 |
| Smiles: | COc1ccc(c(CCNC(CCc2nnc3N(CCc4ccccc4)C(c4ccccc4n23)=O)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1228 |
| logD: | 3.1228 |
| logSw: | -3.5956 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.172 |
| InChI Key: | BWIRQELYBVBFML-UHFFFAOYSA-N |