4-acetamido-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide
Chemical Structure Depiction of
4-acetamido-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide
4-acetamido-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-0510 |
| Compound Name: | 4-acetamido-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide |
| Molecular Weight: | 460.58 |
| Molecular Formula: | C26 H32 N6 O2 |
| Smiles: | CCc1ccccc1/N=C(\NCc1c(C)nn(CC)c1C)NC(c1ccc(cc1)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1484 |
| logD: | 2.5965 |
| logSw: | -3.3665 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.693 |
| InChI Key: | KNRXIWMVTBYAAI-UHFFFAOYSA-N |