N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-0950 |
| Compound Name: | N-{N'-(3-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 454.37 |
| Molecular Formula: | C22 H24 Br N5 O |
| Smiles: | CCn1c(C)c(CN\C(NC(c2ccccc2)=O)=N/c2cccc(c2)[Br])c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.9958 |
| logD: | 3.7765 |
| logSw: | -4.1291 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.129 |
| InChI Key: | YPJLOHHOKGHHII-UHFFFAOYSA-N |