N-{2-[2-({3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)hydrazinyl]-2-oxoethyl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-[2-({3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)hydrazinyl]-2-oxoethyl}-4-methylbenzene-1-sulfonamide
N-{2-[2-({3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)hydrazinyl]-2-oxoethyl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | K089-0171 |
| Compound Name: | N-{2-[2-({3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)hydrazinyl]-2-oxoethyl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 514.56 |
| Molecular Formula: | C23 H26 N6 O6 S |
| Smiles: | Cc1ccc(cc1)S(NCC(N/N=C/c1ccc(c(Cn2c(C)c(c(C)n2)[N+]([O-])=O)c1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7434 |
| logD: | 2.7429 |
| logSw: | -3.5139 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 132.063 |
| InChI Key: | WZMUOZYOHIEYIM-UHFFFAOYSA-N |