N-[1-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide
Chemical Structure Depiction of
N-[1-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide
N-[1-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide
Compound characteristics
| Compound ID: | D524-1234 |
| Compound Name: | N-[1-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide |
| Molecular Weight: | 353.35 |
| Molecular Formula: | C18 H16 F N5 O2 |
| Smiles: | C(c1ccc(cc1)F)NC(Cn1cnc(NC(c2ccccc2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9744 |
| logD: | 1.8098 |
| logSw: | -2.4984 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.023 |
| InChI Key: | DTQHRZMZXARRIQ-UHFFFAOYSA-N |