ethyl 3-amino-3-({amino[(4,7-dimethylquinazolin-2-yl)amino]methylidene}amino)-2-benzoylprop-2-enoate
Chemical Structure Depiction of
ethyl 3-amino-3-({amino[(4,7-dimethylquinazolin-2-yl)amino]methylidene}amino)-2-benzoylprop-2-enoate
ethyl 3-amino-3-({amino[(4,7-dimethylquinazolin-2-yl)amino]methylidene}amino)-2-benzoylprop-2-enoate
Compound characteristics
| Compound ID: | Y021-1881 |
| Compound Name: | ethyl 3-amino-3-({amino[(4,7-dimethylquinazolin-2-yl)amino]methylidene}amino)-2-benzoylprop-2-enoate |
| Molecular Weight: | 432.48 |
| Molecular Formula: | C23 H24 N6 O3 |
| Smiles: | CCOC(C(=C(/N)/N=C(\N)Nc1nc(C)c2ccc(C)cc2n1)\C(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7129 |
| logD: | 2.1535 |
| logSw: | -4.1171 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 115.423 |
| InChI Key: | ONKOOASRAIBBHK-UHFFFAOYSA-N |