N-[4-(butan-2-yl)phenyl]-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[4-(butan-2-yl)phenyl]-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide
N-[4-(butan-2-yl)phenyl]-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y509-0808 |
| Compound Name: | N-[4-(butan-2-yl)phenyl]-1-ethyl-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 316.36 |
| Molecular Formula: | C16 H20 N4 O3 |
| Smiles: | CCC(C)c1ccc(cc1)NC(c1c(cnn1CC)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8331 |
| logD: | 3.806 |
| logSw: | -3.9618 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.365 |
| InChI Key: | ZWVAZLLSAFCBGW-NSHDSACASA-N |