5-(3-methoxyanilino)-3-(2-methylpiperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(3-methoxyanilino)-3-(2-methylpiperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(3-methoxyanilino)-3-(2-methylpiperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C090-0073 |
| Compound Name: | 5-(3-methoxyanilino)-3-(2-methylpiperidin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 439.51 |
| Molecular Formula: | C27 H25 N3 O3 |
| Smiles: | CC1CCCCN1c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1cccc(c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7759 |
| logD: | 6.7759 |
| logSw: | -5.9699 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.376 |
| InChI Key: | APHBENXXUKDELZ-INIZCTEOSA-N |