methyl 3-({5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)-4-methoxybenzoate
Chemical Structure Depiction of
methyl 3-({5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)-4-methoxybenzoate
methyl 3-({5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)-4-methoxybenzoate
Compound characteristics
| Compound ID: | E870-0537 |
| Compound Name: | methyl 3-({5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)-4-methoxybenzoate |
| Molecular Weight: | 442.89 |
| Molecular Formula: | C19 H20 Cl F N2 O5 S |
| Smiles: | COC(c1ccc(c(CN2CCN(Cc3ccc(cc3[Cl])F)S2(=O)=O)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6831 |
| logD: | 3.6831 |
| logSw: | -4.1565 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.549 |
| InChI Key: | XSUOXFPGQJFARA-UHFFFAOYSA-N |