N'-({3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbohydrazide
Chemical Structure Depiction of
N'-({3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbohydrazide
N'-({3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbohydrazide
Compound characteristics
| Compound ID: | K089-0137 |
| Compound Name: | N'-({3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbohydrazide |
| Molecular Weight: | 437.46 |
| Molecular Formula: | C21 H23 N7 O4 |
| Smiles: | Cc1c(c(C)n(Cc2cc(/C=N/NC(c3c4CCCc4[nH]n3)=O)ccc2OC)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3011 |
| logD: | 2.3002 |
| logSw: | -2.8945 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.565 |
| InChI Key: | JFNLENXMIFDINS-UHFFFAOYSA-N |