2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N-(2-hydroxy-4-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N-(2-hydroxy-4-nitrophenyl)prop-2-enamide
2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N-(2-hydroxy-4-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 4397-3485 |
| Compound Name: | 2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N-(2-hydroxy-4-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 437.49 |
| Molecular Formula: | C24 H27 N3 O5 |
| Smiles: | CC(C)(C)c1cc(\C=C(/C#N)C(Nc2ccc(cc2O)[N+]([O-])=O)=O)cc(c1O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 5.7562 |
| logD: | 4.4325 |
| logSw: | -5.2859 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.097 |
| InChI Key: | PVGXOMGEFKGLIZ-UHFFFAOYSA-N |