N-(4-acetamidophenyl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(4-acetamidophenyl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P032-1937 |
| Compound Name: | N-(4-acetamidophenyl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 446.46 |
| Molecular Formula: | C23 H22 N6 O4 |
| Smiles: | CC(Nc1ccc(cc1)NC(CN1C(N2C(C=C(COC)N=C2c2ccccc2)=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8493 |
| logD: | 1.8284 |
| logSw: | -2.3511 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.166 |
| InChI Key: | LWLPAGVIUCUSMD-UHFFFAOYSA-N |