N-[3-(benzylsulfanyl)-1-{2-[(2,5-dimethoxyphenyl)methylidene]hydrazinyl}-1-oxopropan-2-yl]-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-[3-(benzylsulfanyl)-1-{2-[(2,5-dimethoxyphenyl)methylidene]hydrazinyl}-1-oxopropan-2-yl]-3,5-dinitrobenzamide
N-[3-(benzylsulfanyl)-1-{2-[(2,5-dimethoxyphenyl)methylidene]hydrazinyl}-1-oxopropan-2-yl]-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 8007-3274 |
| Compound Name: | N-[3-(benzylsulfanyl)-1-{2-[(2,5-dimethoxyphenyl)methylidene]hydrazinyl}-1-oxopropan-2-yl]-3,5-dinitrobenzamide |
| Molecular Weight: | 567.58 |
| Molecular Formula: | C26 H25 N5 O8 S |
| Smiles: | COc1ccc(c(/C=N/NC(C(CSCc2ccccc2)NC(c2cc(cc(c2)[N+]([O-])=O)[N+]([O-])=O)=O)=O)c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6964 |
| logD: | 4.6957 |
| logSw: | -4.5563 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 141.535 |
| InChI Key: | ZKLGANXWWPVVLS-QHCPKHFHSA-N |