1-[2-(benzylamino)-1,1-difluoro-2-oxoethyl]-N-methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[2-(benzylamino)-1,1-difluoro-2-oxoethyl]-N-methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
1-[2-(benzylamino)-1,1-difluoro-2-oxoethyl]-N-methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SD71-0036 |
| Compound Name: | 1-[2-(benzylamino)-1,1-difluoro-2-oxoethyl]-N-methyl-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 431.44 |
| Molecular Formula: | C20 H23 F2 N7 O2 |
| Smiles: | Cc1c(CN(C)C(c2cn(C(C(NCc3ccccc3)=O)(F)F)nn2)=O)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.9826 |
| logD: | 0.9823 |
| logSw: | -1.7576 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.512 |
| InChI Key: | MFUOLACOJSRCTB-UHFFFAOYSA-N |