N-(5-chloro-2-methoxyphenyl)-2-{[7-(3-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-{[7-(3-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}acetamide
N-(5-chloro-2-methoxyphenyl)-2-{[7-(3-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G802-0037 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-{[7-(3-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 459.88 |
| Molecular Formula: | C20 H15 Cl F N5 O3 S |
| Smiles: | COc1ccc(cc1NC(CSc1nnc2C(N(C=Cn12)c1cccc(c1)F)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.0793 |
| logD: | 2.0764 |
| logSw: | -3.0995 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.784 |
| InChI Key: | NQPWKNCGBGYWMY-UHFFFAOYSA-N |