N-(2,5-dimethylphenyl)-2-{3-[(4-methyl-2-nitrophenoxy)methyl]benzoyl}hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-2-{3-[(4-methyl-2-nitrophenoxy)methyl]benzoyl}hydrazine-1-carbothioamide
N-(2,5-dimethylphenyl)-2-{3-[(4-methyl-2-nitrophenoxy)methyl]benzoyl}hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y502-5983 |
| Compound Name: | N-(2,5-dimethylphenyl)-2-{3-[(4-methyl-2-nitrophenoxy)methyl]benzoyl}hydrazine-1-carbothioamide |
| Molecular Weight: | 464.54 |
| Molecular Formula: | C24 H24 N4 O4 S |
| Smiles: | Cc1ccc(C)c(c1)NC(NNC(c1cccc(COc2ccc(C)cc2[N+]([O-])=O)c1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 4.615 |
| logD: | 4.5325 |
| logSw: | -4.6011 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.863 |
| InChI Key: | SCFFJJVKCOYMSA-UHFFFAOYSA-N |