N-benzyl-1-(methylsulfanyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Chemical Structure Depiction of
N-benzyl-1-(methylsulfanyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
N-benzyl-1-(methylsulfanyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Compound characteristics
| Compound ID: | 8012-4874 |
| Compound Name: | N-benzyl-1-(methylsulfanyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C23 H17 N O3 S |
| Smiles: | CSc1c(ccc2C(c3ccccc3C(c12)=O)=O)C(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0824 |
| logD: | 5.0821 |
| logSw: | -5.0939 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.594 |
| InChI Key: | QABIHVCAZZHFHI-UHFFFAOYSA-N |