N-[(3-bromophenyl)methyl]-2-[2-(4-methoxyphenyl)-7-methyl-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-2-[2-(4-methoxyphenyl)-7-methyl-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
N-[(3-bromophenyl)methyl]-2-[2-(4-methoxyphenyl)-7-methyl-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Compound characteristics
| Compound ID: | E016-1707 |
| Compound Name: | N-[(3-bromophenyl)methyl]-2-[2-(4-methoxyphenyl)-7-methyl-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide |
| Molecular Weight: | 482.34 |
| Molecular Formula: | C22 H20 Br N5 O3 |
| Smiles: | CC1=NN(CC(NCc2cccc(c2)[Br])=O)C(c2cc(c3ccc(cc3)OC)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5847 |
| logD: | 3.5847 |
| logSw: | -3.7937 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.781 |
| InChI Key: | DGIXVOZQSGVMET-UHFFFAOYSA-N |