methyl 4-({3-[(3,4-dichloroanilino)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({3-[(3,4-dichloroanilino)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoate
methyl 4-({3-[(3,4-dichloroanilino)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoate
Compound characteristics
| Compound ID: | 2027-0106 |
| Compound Name: | methyl 4-({3-[(3,4-dichloroanilino)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoate |
| Molecular Weight: | 437.3 |
| Molecular Formula: | C19 H14 Cl2 N2 O4 S |
| Smiles: | COC(c1ccc(\C=C2/C(N(CNc3ccc(c(c3)[Cl])[Cl])C(=O)S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5557 |
| logD: | 5.5557 |
| logSw: | -6.1141 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.929 |
| InChI Key: | BVIZHEHUSFTJLL-UHFFFAOYSA-N |