methyl [(2-carbamoyl-3,5-dinitrophenyl)sulfanyl]acetate
Chemical Structure Depiction of
methyl [(2-carbamoyl-3,5-dinitrophenyl)sulfanyl]acetate
methyl [(2-carbamoyl-3,5-dinitrophenyl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 8009-7209 |
| Compound Name: | methyl [(2-carbamoyl-3,5-dinitrophenyl)sulfanyl]acetate |
| Molecular Weight: | 315.26 |
| Molecular Formula: | C10 H9 N3 O7 S |
| Smiles: | COC(CSc1cc(cc(c1C(N)=O)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.1526 |
| logD: | -0.1526 |
| logSw: | -1.5085 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 121.338 |
| InChI Key: | VMZGTWBHDLXVRK-UHFFFAOYSA-N |