5-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
5-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
5-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | 8013-9537 |
| Compound Name: | 5-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 447.49 |
| Molecular Formula: | C19 H17 N3 O6 S2 |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1cc(/C=C2/C(NC(=N)S2)=O)ccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3219 |
| logD: | 1.3204 |
| logSw: | -2.19 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.254 |
| InChI Key: | CFVTUIUBHDHEKD-UHFFFAOYSA-N |