2-nitro-N-{2,2,2-trichloro-1-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]ethyl}benzamide
Chemical Structure Depiction of
2-nitro-N-{2,2,2-trichloro-1-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]ethyl}benzamide
2-nitro-N-{2,2,2-trichloro-1-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]ethyl}benzamide
Compound characteristics
| Compound ID: | 1501-1146 |
| Compound Name: | 2-nitro-N-{2,2,2-trichloro-1-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]ethyl}benzamide |
| Molecular Weight: | 430.69 |
| Molecular Formula: | C13 H14 Cl3 N3 O5 S |
| Smiles: | C1CS(CC1NC(C([Cl])([Cl])[Cl])NC(c1ccccc1[N+]([O-])=O)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6226 |
| logD: | -0.5454 |
| logSw: | -2.9569 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.015 |
| InChI Key: | WEVYWFQDIWLBAB-UHFFFAOYSA-N |