4-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-chlorobenzoate
Chemical Structure Depiction of
4-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-chlorobenzoate
4-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-chlorobenzoate
Compound characteristics
| Compound ID: | 3681-1296 |
| Compound Name: | 4-[(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-chlorobenzoate |
| Molecular Weight: | 358.8 |
| Molecular Formula: | C17 H11 Cl N2 O3 S |
| Smiles: | C(=C1/C(NC(=N)S1)=O)\c1ccc(cc1)OC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.129 |
| logD: | 3.1275 |
| logSw: | -3.9545 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.891 |
| InChI Key: | KKNBWYYEZHKDAJ-UHFFFAOYSA-N |