N-{N'-(4-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-methylbenzamide
Chemical Structure Depiction of
N-{N'-(4-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-methylbenzamide
N-{N'-(4-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-methylbenzamide
Compound characteristics
| Compound ID: | F340-0461 |
| Compound Name: | N-{N'-(4-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-methylbenzamide |
| Molecular Weight: | 468.4 |
| Molecular Formula: | C23 H26 Br N5 O |
| Smiles: | CCn1c(C)c(CN\C(NC(c2cccc(C)c2)=O)=N/c2ccc(cc2)[Br])c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3324 |
| logD: | 4.1054 |
| logSw: | -4.324 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.129 |
| InChI Key: | ZDNQFEXOWYSNRF-UHFFFAOYSA-N |