ethyl 4-{[{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]amino}(3-fluoro-4-methylbenzamido)methylidene]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]amino}(3-fluoro-4-methylbenzamido)methylidene]amino}benzoate
ethyl 4-{[{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]amino}(3-fluoro-4-methylbenzamido)methylidene]amino}benzoate
Compound characteristics
| Compound ID: | F341-0338 |
| Compound Name: | ethyl 4-{[{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]amino}(3-fluoro-4-methylbenzamido)methylidene]amino}benzoate |
| Molecular Weight: | 493.58 |
| Molecular Formula: | C27 H32 F N5 O3 |
| Smiles: | CCn1c(C)c(CCN/C(NC(c2ccc(C)c(c2)F)=O)=N/c2ccc(cc2)C(=O)OCC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5197 |
| logD: | 4.5003 |
| logSw: | -4.2442 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.725 |
| InChI Key: | ZOUMYONBEPZCDL-UHFFFAOYSA-N |