ethyl 4-[([3-(dimethylamino)benzamido]{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino}methylidene)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[([3-(dimethylamino)benzamido]{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino}methylidene)amino]benzoate
ethyl 4-[([3-(dimethylamino)benzamido]{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino}methylidene)amino]benzoate
Compound characteristics
| Compound ID: | F340-0077 |
| Compound Name: | ethyl 4-[([3-(dimethylamino)benzamido]{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino}methylidene)amino]benzoate |
| Molecular Weight: | 490.61 |
| Molecular Formula: | C27 H34 N6 O3 |
| Smiles: | CCn1c(C)c(CN\C(NC(c2cccc(c2)N(C)C)=O)=N/c2ccc(cc2)C(=O)OCC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0464 |
| logD: | 3.9753 |
| logSw: | -4.052 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.688 |
| InChI Key: | XGAPDWZSBSVGPA-UHFFFAOYSA-N |