methyl 4-methoxy-3-({5-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)benzoate
Chemical Structure Depiction of
methyl 4-methoxy-3-({5-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)benzoate
methyl 4-methoxy-3-({5-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)benzoate
Compound characteristics
| Compound ID: | E870-0595 |
| Compound Name: | methyl 4-methoxy-3-({5-[(4-methylphenyl)methyl]-1,1-dioxo-1lambda~6~,2,5-thiadiazolidin-2-yl}methyl)benzoate |
| Molecular Weight: | 404.48 |
| Molecular Formula: | C20 H24 N2 O5 S |
| Smiles: | Cc1ccc(CN2CCN(Cc3cc(ccc3OC)C(=O)OC)S2(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2498 |
| logD: | 3.2498 |
| logSw: | -3.2616 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.549 |
| InChI Key: | HKYPYJWUQCKNSB-UHFFFAOYSA-N |