N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(4-fluorophenyl)carbamimidoyl}-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(4-fluorophenyl)carbamimidoyl}-3,4-dimethoxybenzamide
N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(4-fluorophenyl)carbamimidoyl}-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | F340-0339 |
| Compound Name: | N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(4-fluorophenyl)carbamimidoyl}-3,4-dimethoxybenzamide |
| Molecular Weight: | 453.52 |
| Molecular Formula: | C24 H28 F N5 O3 |
| Smiles: | CCn1c(C)c(CN\C(NC(c2ccc(c(c2)OC)OC)=O)=N/c2ccc(cc2)F)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7807 |
| logD: | 2.3809 |
| logSw: | -3.3089 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.39 |
| InChI Key: | RFLANGPRUKPFSD-UHFFFAOYSA-N |