N-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1-(1,5-dimethyl-1H-pyrazole-4-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1-(1,5-dimethyl-1H-pyrazole-4-sulfonyl)piperidine-3-carboxamide
N-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1-(1,5-dimethyl-1H-pyrazole-4-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | Y503-3759 |
| Compound Name: | N-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1-(1,5-dimethyl-1H-pyrazole-4-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 453.52 |
| Molecular Formula: | C18 H27 N7 O5 S |
| Smiles: | Cc1c(c(C)n(CCNC(C2CCCN(C2)S(c2cnn(C)c2C)(=O)=O)=O)n1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.6047 |
| logD: | -0.6047 |
| logSw: | -1.6196 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.936 |
| InChI Key: | SJTYTWSQVKBHSH-HNNXBMFYSA-N |