N-[3-(methoxymethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide
Chemical Structure Depiction of
N-[3-(methoxymethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide
N-[3-(methoxymethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide
Compound characteristics
| Compound ID: | S637-0699 |
| Compound Name: | N-[3-(methoxymethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetamide |
| Molecular Weight: | 386.37 |
| Molecular Formula: | C16 H21 F3 N6 O2 |
| Smiles: | Cc1cc(C(F)(F)F)nn1CC(NC1CCc2nnc(COC)n2CC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.0964 |
| logD: | 0.0955 |
| logSw: | -1.1784 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.868 |
| InChI Key: | VWGFXQXZRYEFQR-NSHDSACASA-N |