1-methyl-N-[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1-methyl-N-[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]-4-nitro-1H-pyrazole-5-carboxamide
1-methyl-N-[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-2168 |
| Compound Name: | 1-methyl-N-[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 373.33 |
| Molecular Formula: | C15 H15 N7 O5 |
| Smiles: | Cn1c(C(Nc2ccc(c3c2non3)N2CCOCC2)=O)c(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.4987 |
| logD: | 1.4763 |
| logSw: | -2.1129 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.148 |
| InChI Key: | GJHSRPFLYHAGBN-UHFFFAOYSA-N |