N-{N'-(3-chloro-4-fluorophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-2-methylbenzamide
Chemical Structure Depiction of
N-{N'-(3-chloro-4-fluorophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-2-methylbenzamide
N-{N'-(3-chloro-4-fluorophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-2-methylbenzamide
Compound characteristics
| Compound ID: | F340-1129 |
| Compound Name: | N-{N'-(3-chloro-4-fluorophenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-2-methylbenzamide |
| Molecular Weight: | 441.93 |
| Molecular Formula: | C23 H25 Cl F N5 O |
| Smiles: | CCn1c(C)c(CN\C(NC(c2ccccc2C)=O)=N/c2ccc(c(c2)[Cl])F)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.121 |
| logD: | 3.8003 |
| logSw: | -4.5137 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.129 |
| InChI Key: | JSUHPHQYTXCRHM-UHFFFAOYSA-N |