N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(4-fluorophenyl)carbamimidoyl}-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(4-fluorophenyl)carbamimidoyl}-3,4,5-trimethoxybenzamide
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(4-fluorophenyl)carbamimidoyl}-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | F341-0939 |
| Compound Name: | N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(4-fluorophenyl)carbamimidoyl}-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 497.57 |
| Molecular Formula: | C26 H32 F N5 O4 |
| Smiles: | CCn1c(C)c(CCN\C(NC(c2cc(c(c(c2)OC)OC)OC)=O)=N/c2ccc(cc2)F)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0587 |
| logD: | 2.9539 |
| logSw: | -3.3952 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.949 |
| InChI Key: | MBQPQKXMSVCCFG-UHFFFAOYSA-N |