N-[(4-chlorophenyl)methyl]-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
N-[(4-chlorophenyl)methyl]-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P573-6371 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 422.87 |
| Molecular Formula: | C21 H19 Cl N6 O2 |
| Smiles: | Cc1ccc(cc1)NC1C=CN2C(N=1)=NN(CC(NCc1ccc(cc1)[Cl])=O)C2=O |
| Stereo: | ACHIRAL |
| logP: | 3.392 |
| logD: | 3.3914 |
| logSw: | -3.7905 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.317 |
| InChI Key: | BSVDIYKAHQIRMH-UHFFFAOYSA-N |