4-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(furan-2-yl)methyl]-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(furan-2-yl)methyl]-3-nitrobenzamide
4-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(furan-2-yl)methyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | D051-0257 |
| Compound Name: | 4-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(furan-2-yl)methyl]-3-nitrobenzamide |
| Molecular Weight: | 398.82 |
| Molecular Formula: | C16 H15 Cl N2 O6 S |
| Smiles: | C1CS(CC1N(Cc1ccco1)C(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6589 |
| logD: | 1.6589 |
| logSw: | -2.7744 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.689 |
| InChI Key: | ZOZOWIWVOUKNSJ-LBPRGKRZSA-N |