5-hydroxy-7,8-dimethyl-4-phenyl-2H-naphtho[2,1-d][1,3]oxathiol-2-one
Chemical Structure Depiction of
5-hydroxy-7,8-dimethyl-4-phenyl-2H-naphtho[2,1-d][1,3]oxathiol-2-one
5-hydroxy-7,8-dimethyl-4-phenyl-2H-naphtho[2,1-d][1,3]oxathiol-2-one
Compound characteristics
| Compound ID: | 6957-0085 |
| Compound Name: | 5-hydroxy-7,8-dimethyl-4-phenyl-2H-naphtho[2,1-d][1,3]oxathiol-2-one |
| Molecular Weight: | 322.38 |
| Molecular Formula: | C19 H14 O3 S |
| Smiles: | Cc1cc2c(c(c3ccccc3)c3c(c2cc1C)OC(=O)S3)O |
| Stereo: | ACHIRAL |
| logP: | 5.4624 |
| logD: | 5.4623 |
| logSw: | -5.6026 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.931 |
| InChI Key: | CNEVPARHIUXNQD-UHFFFAOYSA-N |