2-bromo-N-{N'-(3,5-dimethylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
2-bromo-N-{N'-(3,5-dimethylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
2-bromo-N-{N'-(3,5-dimethylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F341-0787 |
| Compound Name: | 2-bromo-N-{N'-(3,5-dimethylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide |
| Molecular Weight: | 496.45 |
| Molecular Formula: | C25 H30 Br N5 O |
| Smiles: | CCn1c(C)c(CCN/C(NC(c2ccccc2[Br])=O)=N/c2cc(C)cc(C)c2)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.6108 |
| logD: | 4.1886 |
| logSw: | -4.3848 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.971 |
| InChI Key: | YOKSWBOBKNOGKI-UHFFFAOYSA-N |