N-(3-ethylphenyl)-2-[(8-oxo-7-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-ethylphenyl)-2-[(8-oxo-7-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)sulfanyl]acetamide
N-(3-ethylphenyl)-2-[(8-oxo-7-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G802-0552 |
| Compound Name: | N-(3-ethylphenyl)-2-[(8-oxo-7-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 405.48 |
| Molecular Formula: | C21 H19 N5 O2 S |
| Smiles: | CCc1cccc(c1)NC(CSc1nnc2C(N(C=Cn12)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4047 |
| logD: | 2.4047 |
| logSw: | -2.9262 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.852 |
| InChI Key: | WMVCEOLZQPNDHS-UHFFFAOYSA-N |