3-(pyrrolidin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-(pyrrolidin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-(pyrrolidin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0687 |
| Compound Name: | 3-(pyrrolidin-1-yl)-5-(2,4,6-trimethylanilino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C27 H25 N3 O2 |
| Smiles: | Cc1cc(C)c(c(C)c1)Nc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 6.8497 |
| logD: | 6.8497 |
| logSw: | -5.9542 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.517 |
| InChI Key: | GRUDBSASAPHYEP-UHFFFAOYSA-N |