N-(2-bromo-4-methylphenyl)-2-[8-(4-methylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(2-bromo-4-methylphenyl)-2-[8-(4-methylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
N-(2-bromo-4-methylphenyl)-2-[8-(4-methylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M446-0222 |
| Compound Name: | N-(2-bromo-4-methylphenyl)-2-[8-(4-methylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide |
| Molecular Weight: | 468.31 |
| Molecular Formula: | C21 H18 Br N5 O3 |
| Smiles: | Cc1ccc(cc1)OC1C2=NN(CC(Nc3ccc(C)cc3[Br])=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3961 |
| logD: | 3.3961 |
| logSw: | -3.6685 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.517 |
| InChI Key: | QYCBWDMNCMCHIQ-UHFFFAOYSA-N |