N-[2-(4-chlorophenyl)ethyl]-4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide
N-[2-(4-chlorophenyl)ethyl]-4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide
Compound characteristics
| Compound ID: | G423-0625 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide |
| Molecular Weight: | 493.99 |
| Molecular Formula: | C26 H28 Cl N5 O3 |
| Smiles: | CCOc1ccc(cc1)N1C=Cn2c(CC(C)CC(NCCc3ccc(cc3)[Cl])=O)nnc2C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5066 |
| logD: | 2.5066 |
| logSw: | -3.3206 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.533 |
| InChI Key: | SLKHFCLPTUZKHG-GOSISDBHSA-N |