2-(azepane-1-carbonyl)-1-[(2-hydroxyethyl)amino]anthracene-9,10-dione
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-1-[(2-hydroxyethyl)amino]anthracene-9,10-dione
2-(azepane-1-carbonyl)-1-[(2-hydroxyethyl)amino]anthracene-9,10-dione
Compound characteristics
| Compound ID: | C092-0010 |
| Compound Name: | 2-(azepane-1-carbonyl)-1-[(2-hydroxyethyl)amino]anthracene-9,10-dione |
| Molecular Weight: | 392.45 |
| Molecular Formula: | C23 H24 N2 O4 |
| Smiles: | C1CCCN(CC1)C(c1ccc2C(c3ccccc3C(c2c1NCCO)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2146 |
| logD: | 3.2146 |
| logSw: | -3.8034 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.767 |
| InChI Key: | JTSPMDFRBOBSON-UHFFFAOYSA-N |