N-{3-(benzylsulfanyl)-1-oxo-1-[2-({4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)hydrazinyl]propan-2-yl}-4-nitrobenzamide
Chemical Structure Depiction of
N-{3-(benzylsulfanyl)-1-oxo-1-[2-({4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)hydrazinyl]propan-2-yl}-4-nitrobenzamide
N-{3-(benzylsulfanyl)-1-oxo-1-[2-({4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)hydrazinyl]propan-2-yl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | 8003-8897 |
| Compound Name: | N-{3-(benzylsulfanyl)-1-oxo-1-[2-({4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)hydrazinyl]propan-2-yl}-4-nitrobenzamide |
| Molecular Weight: | 518.59 |
| Molecular Formula: | C27 H26 N4 O5 S |
| Smiles: | C=CCOc1ccc(/C=N/NC(C(CSCc2ccccc2)NC(c2ccc(cc2)[N+]([O-])=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7351 |
| logD: | 4.7337 |
| logSw: | -4.8177 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.397 |
| InChI Key: | CDYKJGHXAZIRNW-VWLOTQADSA-N |