3-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate
Chemical Structure Depiction of
3-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate
3-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate
Compound characteristics
| Compound ID: | 3681-1304 |
| Compound Name: | 3-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate |
| Molecular Weight: | 338.38 |
| Molecular Formula: | C18 H14 N2 O3 S |
| Smiles: | Cc1ccc(cc1)C(=O)Oc1cccc(/C=C2/C(NC(=N)S2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.8464 |
| logD: | 2.8449 |
| logSw: | -3.4158 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.891 |
| InChI Key: | OCVNKCDSEOIPJC-UHFFFAOYSA-N |