3-({5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)-4-methoxybenzaldehyde
Chemical Structure Depiction of
3-({5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)-4-methoxybenzaldehyde
3-({5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)-4-methoxybenzaldehyde
Compound characteristics
| Compound ID: | G347-0777 |
| Compound Name: | 3-({5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)-4-methoxybenzaldehyde |
| Molecular Weight: | 412.87 |
| Molecular Formula: | C18 H18 Cl F N2 O4 S |
| Smiles: | COc1ccc(C=O)cc1CN1CCN(Cc2ccc(cc2[Cl])F)S1(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0799 |
| logD: | 3.0799 |
| logSw: | -3.5241 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.534 |
| InChI Key: | IEBPCRWREKGLAP-UHFFFAOYSA-N |