5-{[2-(azepan-1-yl)ethyl]amino}-3-(dimethylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-{[2-(azepan-1-yl)ethyl]amino}-3-(dimethylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-{[2-(azepan-1-yl)ethyl]amino}-3-(dimethylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | C620-0102 |
| Compound Name: | 5-{[2-(azepan-1-yl)ethyl]amino}-3-(dimethylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C24 H28 N4 O2 |
| Smiles: | CN(C)c1cc(c2C(c3ccccc3c3c2c1no3)=O)NCCN1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.1439 |
| logD: | 3.5532 |
| logSw: | -5.0309 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.376 |
| InChI Key: | FGYXTVKSEZJPMM-UHFFFAOYSA-N |