5-(azepan-1-yl)-3-(phenylsulfanyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(azepan-1-yl)-3-(phenylsulfanyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(azepan-1-yl)-3-(phenylsulfanyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | 8016-7024 |
| Compound Name: | 5-(azepan-1-yl)-3-(phenylsulfanyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 426.54 |
| Molecular Formula: | C26 H22 N2 O2 S |
| Smiles: | C1CCCN(CC1)c1cc(c2c3c1C(c1ccccc1c3on2)=O)Sc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.0731 |
| logD: | 7.0731 |
| logSw: | -6.3214 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.392 |
| InChI Key: | ZZWADUNOGUWMSX-UHFFFAOYSA-N |