4-[7-(3,4-difluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[(4-methoxyphenyl)methyl]butanamide
Chemical Structure Depiction of
4-[7-(3,4-difluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[(4-methoxyphenyl)methyl]butanamide
4-[7-(3,4-difluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[(4-methoxyphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | G423-0371 |
| Compound Name: | 4-[7-(3,4-difluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-[(4-methoxyphenyl)methyl]butanamide |
| Molecular Weight: | 453.45 |
| Molecular Formula: | C23 H21 F2 N5 O3 |
| Smiles: | COc1ccc(CNC(CCCc2nnc3C(N(C=Cn23)c2ccc(c(c2)F)F)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.2742 |
| logD: | 1.2742 |
| logSw: | -2.1119 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.112 |
| InChI Key: | BCVQQQJSQUNAJI-UHFFFAOYSA-N |