2-{5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-{5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | E870-0499 |
| Compound Name: | 2-{5-[(2-chloro-4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 485.96 |
| Molecular Formula: | C21 H25 Cl F N3 O5 S |
| Smiles: | COc1ccc(CCNC(CN2CCN(Cc3ccc(cc3[Cl])F)S2(=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.9729 |
| logD: | 1.9729 |
| logSw: | -3.0686 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.318 |
| InChI Key: | GZSJYPLPNTZAFN-UHFFFAOYSA-N |