N-(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-4-nitrobenzamide
Chemical Structure Depiction of
N-(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-4-nitrobenzamide
N-(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 2548-0759 |
| Compound Name: | N-(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-4-nitrobenzamide |
| Molecular Weight: | 284.27 |
| Molecular Formula: | C15 H12 N2 O4 |
| Smiles: | CC1=CC(C=C(C)C1=O)=NC(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9578 |
| logD: | 1.4947 |
| logSw: | -3.3823 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.343 |
| InChI Key: | SACRATSCDDKPKB-UHFFFAOYSA-N |