N-[3-(azepan-1-yl)propyl]-2-[2-(4-ethylphenyl)-7-methyl-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-2-[2-(4-ethylphenyl)-7-methyl-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
N-[3-(azepan-1-yl)propyl]-2-[2-(4-ethylphenyl)-7-methyl-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Compound characteristics
| Compound ID: | E016-2790 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-2-[2-(4-ethylphenyl)-7-methyl-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide |
| Molecular Weight: | 450.58 |
| Molecular Formula: | C25 H34 N6 O2 |
| Smiles: | CCc1ccc(cc1)c1cc2C(N(CC(NCCCN3CCCCCC3)=O)N=C(C)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4197 |
| logD: | 0.791 |
| logSw: | -3.4649 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.393 |
| InChI Key: | VYEVQTCEKJGXKD-UHFFFAOYSA-N |