2-[8-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(3-ethylphenyl)acetamide
Chemical Structure Depiction of
2-[8-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(3-ethylphenyl)acetamide
2-[8-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(3-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | M451-1819 |
| Compound Name: | 2-[8-(cyclohexylsulfanyl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(3-ethylphenyl)acetamide |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C21 H25 N5 O2 S |
| Smiles: | CCc1cccc(c1)NC(CN1C(N2C=CN=C(C2=N1)SC1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9777 |
| logD: | 3.9777 |
| logSw: | -3.9096 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.779 |
| InChI Key: | MAEVIXUBGMFCCA-UHFFFAOYSA-N |