2-[6-(4-methoxyphenyl)-3,5-dioxo-6,7-dihydro-3H-imidazo[5,1-c][1,2,4]triazol-2(5H)-yl]-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[6-(4-methoxyphenyl)-3,5-dioxo-6,7-dihydro-3H-imidazo[5,1-c][1,2,4]triazol-2(5H)-yl]-N-[(4-methylphenyl)methyl]acetamide
2-[6-(4-methoxyphenyl)-3,5-dioxo-6,7-dihydro-3H-imidazo[5,1-c][1,2,4]triazol-2(5H)-yl]-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | 8020-5162 |
| Compound Name: | 2-[6-(4-methoxyphenyl)-3,5-dioxo-6,7-dihydro-3H-imidazo[5,1-c][1,2,4]triazol-2(5H)-yl]-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 407.43 |
| Molecular Formula: | C21 H21 N5 O4 |
| Smiles: | Cc1ccc(CNC(CN2C(N3C(CN(C3=O)c3ccc(cc3)OC)=N2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.2031 |
| logD: | 2.2031 |
| logSw: | -2.6946 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.17 |
| InChI Key: | GQOOOTJXCILGRX-UHFFFAOYSA-N |