N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(3-fluorophenyl)carbamimidoyl}-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(3-fluorophenyl)carbamimidoyl}-3,4,5-trimethoxybenzamide
N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(3-fluorophenyl)carbamimidoyl}-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | F340-1192 |
| Compound Name: | N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(3-fluorophenyl)carbamimidoyl}-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 483.54 |
| Molecular Formula: | C25 H30 F N5 O4 |
| Smiles: | CCn1c(C)c(CN\C(NC(c2cc(c(c(c2)OC)OC)OC)=O)=N/c2cccc(c2)F)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.1635 |
| logD: | 2.9919 |
| logSw: | -3.3681 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.107 |
| InChI Key: | GEOXNVXVJRUHII-UHFFFAOYSA-N |