methyl (3,6,11-trioxo-6,11-dihydroanthra[2,1-d][1,2]thiazol-2(3H)-yl)acetate
Chemical Structure Depiction of
methyl (3,6,11-trioxo-6,11-dihydroanthra[2,1-d][1,2]thiazol-2(3H)-yl)acetate
methyl (3,6,11-trioxo-6,11-dihydroanthra[2,1-d][1,2]thiazol-2(3H)-yl)acetate
Compound characteristics
| Compound ID: | 8013-2919 |
| Compound Name: | methyl (3,6,11-trioxo-6,11-dihydroanthra[2,1-d][1,2]thiazol-2(3H)-yl)acetate |
| Molecular Weight: | 353.35 |
| Molecular Formula: | C18 H11 N O5 S |
| Smiles: | COC(CN1C(c2ccc3C(c4ccccc4C(c3c2S1)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7225 |
| logD: | 2.7225 |
| logSw: | -3.4121 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.42 |
| InChI Key: | PZIUBRIVUSAERE-UHFFFAOYSA-N |