4-{[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-chloro-6-methoxyphenyl acetate
Chemical Structure Depiction of
4-{[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-chloro-6-methoxyphenyl acetate
4-{[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-chloro-6-methoxyphenyl acetate
Compound characteristics
| Compound ID: | 8012-5297 |
| Compound Name: | 4-{[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-2-chloro-6-methoxyphenyl acetate |
| Molecular Weight: | 451.84 |
| Molecular Formula: | C17 H14 Cl N5 O6 S |
| Smiles: | CC(Nc1c(non1)N1C(=N)SC(=C\c2cc(c(c(c2)[Cl])OC(C)=O)OC)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4309 |
| logD: | 1.0285 |
| logSw: | -3.4727 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 121.376 |
| InChI Key: | IHSWXAUECZEBOY-UHFFFAOYSA-N |