4-methyl-N-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide
Chemical Structure Depiction of
4-methyl-N-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide
4-methyl-N-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide
Compound characteristics
| Compound ID: | D524-1335 |
| Compound Name: | 4-methyl-N-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide |
| Molecular Weight: | 363.42 |
| Molecular Formula: | C20 H21 N5 O2 |
| Smiles: | Cc1ccc(CNC(Cn2cnc(NC(c3ccc(C)cc3)=O)n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8972 |
| logD: | 2.6984 |
| logSw: | -3.2447 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.023 |
| InChI Key: | BDJMZJSNBDMRFU-UHFFFAOYSA-N |