3-(3-methylpiperidin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(3-methylpiperidin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(3-methylpiperidin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0686 |
| Compound Name: | 3-(3-methylpiperidin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 451.57 |
| Molecular Formula: | C29 H29 N3 O2 |
| Smiles: | CC1CCCN(C1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1c(C)cc(C)cc1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.324 |
| logD: | 7.324 |
| logSw: | -5.9594 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.085 |
| InChI Key: | PHTOAFSQPISURB-INIZCTEOSA-N |