2-bromo-4-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-bromo-4-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzene-1-sulfonate
2-bromo-4-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | 8013-9533 |
| Compound Name: | 2-bromo-4-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 469.33 |
| Molecular Formula: | C17 H13 Br N2 O5 S2 |
| Smiles: | COc1ccc(cc1)S(=O)(=O)Oc1ccc(/C=C2/C(NC(=N)S2)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.6846 |
| logD: | 2.683 |
| logSw: | -3.4364 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.906 |
| InChI Key: | LRIYZXHEZLESKT-UHFFFAOYSA-N |