N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-methylphenyl)carbamimidoyl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-methylphenyl)carbamimidoyl}-3-fluorobenzamide
N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-methylphenyl)carbamimidoyl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | F340-0799 |
| Compound Name: | N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-methylphenyl)carbamimidoyl}-3-fluorobenzamide |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C23 H26 F N5 O |
| Smiles: | CCn1c(C)c(CN\C(NC(c2cccc(c2)F)=O)=N/c2ccccc2C)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6907 |
| logD: | 3.0345 |
| logSw: | -4.0926 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.432 |
| InChI Key: | RMSBBGHOVLDJRL-UHFFFAOYSA-N |