2-bromo-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide
Chemical Structure Depiction of
2-bromo-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide
2-bromo-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-0846 |
| Compound Name: | 2-bromo-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide |
| Molecular Weight: | 482.42 |
| Molecular Formula: | C24 H28 Br N5 O |
| Smiles: | CCc1ccccc1/N=C(\NCc1c(C)nn(CC)c1C)NC(c1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2565 |
| logD: | 3.9185 |
| logSw: | -4.3274 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.432 |
| InChI Key: | SQQXJJULFJFKIR-UHFFFAOYSA-N |