2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}-4-ethyl-1,3-oxazolidine
Chemical Structure Depiction of
2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}-4-ethyl-1,3-oxazolidine
2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}-4-ethyl-1,3-oxazolidine
Compound characteristics
| Compound ID: | 4872-0324 |
| Compound Name: | 2-{3,3-dichloro-2-[(4-methylphenyl)sulfanyl]-1-nitroprop-2-en-1-ylidene}-4-ethyl-1,3-oxazolidine |
| Molecular Weight: | 375.27 |
| Molecular Formula: | C15 H16 Cl2 N2 O3 S |
| Smiles: | CCC1COC(=C(/C(=C([Cl])[Cl])Sc2ccc(C)cc2)[N+]([O-])=O)\N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4108 |
| logD: | 5.4107 |
| logSw: | -5.9497 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.761 |
| InChI Key: | MPQSPSFKQLCLCZ-SNVBAGLBSA-N |