1-[(2-hydroxyethyl)sulfanyl]-N-(3-methylphenyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Chemical Structure Depiction of
1-[(2-hydroxyethyl)sulfanyl]-N-(3-methylphenyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
1-[(2-hydroxyethyl)sulfanyl]-N-(3-methylphenyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Compound characteristics
| Compound ID: | 8012-7649 |
| Compound Name: | 1-[(2-hydroxyethyl)sulfanyl]-N-(3-methylphenyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C24 H19 N O4 S |
| Smiles: | Cc1cccc(c1)NC(c1ccc2C(c3ccccc3C(c2c1SCCO)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4907 |
| logD: | 4.4902 |
| logSw: | -4.5014 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.927 |
| InChI Key: | LTZJRDZFFHQVQA-UHFFFAOYSA-N |