3-bromo-5-(phenylsulfanyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
3-bromo-5-(phenylsulfanyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
3-bromo-5-(phenylsulfanyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
| Compound ID: | 0828-0032 |
| Compound Name: | 3-bromo-5-(phenylsulfanyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
| Molecular Weight: | 408.27 |
| Molecular Formula: | C20 H10 Br N O2 S |
| Smiles: | c1ccc(cc1)Sc1cc(c2c3c1C(c1ccccc1c3on2)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.0899 |
| logD: | 6.0899 |
| logSw: | -6.2059 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.909 |
| InChI Key: | PGLCXSDFIXKVKF-UHFFFAOYSA-N |