1-[2-(benzylamino)-1,1-difluoro-2-oxoethyl]-N-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-N-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[2-(benzylamino)-1,1-difluoro-2-oxoethyl]-N-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-N-methyl-1H-1,2,3-triazole-4-carboxamide
1-[2-(benzylamino)-1,1-difluoro-2-oxoethyl]-N-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-N-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SD71-0037 |
| Compound Name: | 1-[2-(benzylamino)-1,1-difluoro-2-oxoethyl]-N-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-N-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 431.44 |
| Molecular Formula: | C20 H23 F2 N7 O2 |
| Smiles: | CCn1c(C)c(CN(C)C(c2cn(C(C(NCc3ccccc3)=O)(F)F)nn2)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 1.397 |
| logD: | 1.3966 |
| logSw: | -1.9395 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.597 |
| InChI Key: | BVTLATXRGMEDQK-UHFFFAOYSA-N |