N-{N'-(4-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-difluorobenzamide
Chemical Structure Depiction of
N-{N'-(4-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-difluorobenzamide
N-{N'-(4-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-difluorobenzamide
Compound characteristics
| Compound ID: | F340-0619 |
| Compound Name: | N-{N'-(4-bromophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-difluorobenzamide |
| Molecular Weight: | 490.35 |
| Molecular Formula: | C22 H22 Br F2 N5 O |
| Smiles: | CCn1c(C)c(CN\C(NC(c2ccc(c(c2)F)F)=O)=N/c2ccc(cc2)[Br])c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3377 |
| logD: | 4.1046 |
| logSw: | -4.3229 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.129 |
| InChI Key: | UKUWZDJVKWLMCU-UHFFFAOYSA-N |