2-methyl-7-[(4-methylphenyl)sulfanyl]anthra[2,1-b]benzo[d]thiophene-8,13-dione
Chemical Structure Depiction of
2-methyl-7-[(4-methylphenyl)sulfanyl]anthra[2,1-b]benzo[d]thiophene-8,13-dione
2-methyl-7-[(4-methylphenyl)sulfanyl]anthra[2,1-b]benzo[d]thiophene-8,13-dione
Compound characteristics
| Compound ID: | 8019-9547 |
| Compound Name: | 2-methyl-7-[(4-methylphenyl)sulfanyl]anthra[2,1-b]benzo[d]thiophene-8,13-dione |
| Molecular Weight: | 450.58 |
| Molecular Formula: | C28 H18 O2 S2 |
| Smiles: | Cc1ccc(cc1)Sc1cc2c(c3C(c4ccccc4C(c13)=O)=O)c1cc(C)ccc1s2 |
| Stereo: | ACHIRAL |
| logP: | 8.7863 |
| logD: | 8.7863 |
| logSw: | -6.2176 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 26.3841 |
| InChI Key: | MWJWEUWVUCYSLT-UHFFFAOYSA-N |