N-(4-chloro-3-nitrophenyl)-2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-(4-chloro-3-nitrophenyl)-2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)prop-2-enamide
N-(4-chloro-3-nitrophenyl)-2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | Y505-4452 |
| Compound Name: | N-(4-chloro-3-nitrophenyl)-2-cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)prop-2-enamide |
| Molecular Weight: | 455.94 |
| Molecular Formula: | C24 H26 Cl N3 O4 |
| Smiles: | CC(C)(C)c1cc(\C=C(/C#N)C(Nc2ccc(c(c2)[N+]([O-])=O)[Cl])=O)cc(c1O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 6.3866 |
| logD: | 4.4996 |
| logSw: | -5.9016 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.946 |
| InChI Key: | BNLNWAAOVMYHDQ-UHFFFAOYSA-N |