ethyl 4-{[{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino}(3-fluorobenzamido)methylidene]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino}(3-fluorobenzamido)methylidene]amino}benzoate
ethyl 4-{[{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino}(3-fluorobenzamido)methylidene]amino}benzoate
Compound characteristics
| Compound ID: | F340-0806 |
| Compound Name: | ethyl 4-{[{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino}(3-fluorobenzamido)methylidene]amino}benzoate |
| Molecular Weight: | 465.53 |
| Molecular Formula: | C25 H28 F N5 O3 |
| Smiles: | CCn1c(C)c(CN\C(NC(c2cccc(c2)F)=O)=N/c2ccc(cc2)C(=O)OCC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.8516 |
| logD: | 3.7797 |
| logSw: | -4.0606 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.883 |
| InChI Key: | KRZMNZQYXONRTM-UHFFFAOYSA-N |