6-(4-methylpiperazine-1-sulfonyl)-2-(2-phenoxyethyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
6-(4-methylpiperazine-1-sulfonyl)-2-(2-phenoxyethyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
6-(4-methylpiperazine-1-sulfonyl)-2-(2-phenoxyethyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | P047-0487 |
| Compound Name: | 6-(4-methylpiperazine-1-sulfonyl)-2-(2-phenoxyethyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 417.49 |
| Molecular Formula: | C19 H23 N5 O4 S |
| Smiles: | CN1CCN(CC1)S(C1C=CC2=NN(CCOc3ccccc3)C(N2C=1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2964 |
| logD: | 1.1462 |
| logSw: | -2.1222 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.383 |
| InChI Key: | IZGHHUFOBCAELO-UHFFFAOYSA-N |