1-methyl-N-{1-[2-(morpholin-4-yl)ethyl]-1H-benzimidazol-2-yl}-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1-methyl-N-{1-[2-(morpholin-4-yl)ethyl]-1H-benzimidazol-2-yl}-4-nitro-1H-pyrazole-5-carboxamide
1-methyl-N-{1-[2-(morpholin-4-yl)ethyl]-1H-benzimidazol-2-yl}-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-2165 |
| Compound Name: | 1-methyl-N-{1-[2-(morpholin-4-yl)ethyl]-1H-benzimidazol-2-yl}-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 399.41 |
| Molecular Formula: | C18 H21 N7 O4 |
| Smiles: | Cn1c(C(Nc2nc3ccccc3n2CCN2CCOCC2)=O)c(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.0905 |
| logD: | 0.9466 |
| logSw: | -2.0829 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.632 |
| InChI Key: | HMYMBOIAIGLLMW-UHFFFAOYSA-N |