3-(3,5-dimethylpiperidin-1-yl)-5-(3,4,5-trimethoxyanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(3,5-dimethylpiperidin-1-yl)-5-(3,4,5-trimethoxyanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(3,5-dimethylpiperidin-1-yl)-5-(3,4,5-trimethoxyanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C090-0234 |
| Compound Name: | 3-(3,5-dimethylpiperidin-1-yl)-5-(3,4,5-trimethoxyanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 513.59 |
| Molecular Formula: | C30 H31 N3 O5 |
| Smiles: | CC1CC(C)CN(C1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1cc(c(c(c1)OC)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.7366 |
| logD: | 6.7366 |
| logSw: | -6.0032 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.392 |
| InChI Key: | XOBRRAGUEOJUIO-UHFFFAOYSA-N |