N-[3-(benzylsulfanyl)-1-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-1-oxopropan-2-yl]-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-[3-(benzylsulfanyl)-1-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-1-oxopropan-2-yl]-3,5-dinitrobenzamide
N-[3-(benzylsulfanyl)-1-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-1-oxopropan-2-yl]-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 8003-8655 |
| Compound Name: | N-[3-(benzylsulfanyl)-1-{2-[(3-nitrophenyl)methylidene]hydrazinyl}-1-oxopropan-2-yl]-3,5-dinitrobenzamide |
| Molecular Weight: | 552.52 |
| Molecular Formula: | C24 H20 N6 O8 S |
| Smiles: | C(C(C(N/N=C/c1cccc(c1)[N+]([O-])=O)=O)NC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)SCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2162 |
| logD: | 4.214 |
| logSw: | -4.4172 |
| Hydrogen bond acceptors count: | 18 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 159.742 |
| InChI Key: | NMNTWBKLOJGZOM-QFIPXVFZSA-N |