2-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
Chemical Structure Depiction of
2-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
2-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | D111-0009 |
| Compound Name: | 2-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide |
| Molecular Weight: | 453.94 |
| Molecular Formula: | C21 H24 Cl N O6 S |
| Smiles: | COc1cc(CN(C2CCS(C2)(=O)=O)C(c2ccccc2[Cl])=O)cc(c1OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9477 |
| logD: | 1.9477 |
| logSw: | -3.2571 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.838 |
| InChI Key: | RDNDZKULLGFQTA-HNNXBMFYSA-N |