3-(3,5-dimethylpiperidin-1-yl)-5-({2-[(2-hydroxyethyl)(methyl)amino]ethyl}amino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(3,5-dimethylpiperidin-1-yl)-5-({2-[(2-hydroxyethyl)(methyl)amino]ethyl}amino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(3,5-dimethylpiperidin-1-yl)-5-({2-[(2-hydroxyethyl)(methyl)amino]ethyl}amino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0094 |
| Compound Name: | 3-(3,5-dimethylpiperidin-1-yl)-5-({2-[(2-hydroxyethyl)(methyl)amino]ethyl}amino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C26 H32 N4 O3 |
| Smiles: | CC1CC(C)CN(C1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)NCCN(C)CCO |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4673 |
| logD: | 3.7353 |
| logSw: | -4.5916 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.577 |
| InChI Key: | STRQQDBSPDDDDU-UHFFFAOYSA-N |