N-{N'-(3,5-dimethoxyphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{N'-(3,5-dimethoxyphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-fluorobenzamide
N-{N'-(3,5-dimethoxyphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | F340-0828 |
| Compound Name: | N-{N'-(3,5-dimethoxyphenyl)-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3-fluorobenzamide |
| Molecular Weight: | 453.52 |
| Molecular Formula: | C24 H28 F N5 O3 |
| Smiles: | CCn1c(C)c(CN\C(NC(c2cccc(c2)F)=O)=N/c2cc(cc(c2)OC)OC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6669 |
| logD: | 3.2892 |
| logSw: | -4.1427 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.217 |
| InChI Key: | KHIUVEWFGSYUCT-UHFFFAOYSA-N |