3-(3-methylpiperidin-1-yl)-5-(3,4,5-trimethoxyanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(3-methylpiperidin-1-yl)-5-(3,4,5-trimethoxyanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(3-methylpiperidin-1-yl)-5-(3,4,5-trimethoxyanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C090-0090 |
| Compound Name: | 3-(3-methylpiperidin-1-yl)-5-(3,4,5-trimethoxyanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 499.57 |
| Molecular Formula: | C29 H29 N3 O5 |
| Smiles: | CC1CCCN(C1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1cc(c(c(c1)OC)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2035 |
| logD: | 6.2035 |
| logSw: | -5.7626 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.458 |
| InChI Key: | KKVUREJQJJWHPA-INIZCTEOSA-N |