1-methyl-N-[3-(morpholin-4-yl)propyl]-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1-methyl-N-[3-(morpholin-4-yl)propyl]-4-nitro-1H-pyrazole-5-carboxamide
1-methyl-N-[3-(morpholin-4-yl)propyl]-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y508-3678 |
| Compound Name: | 1-methyl-N-[3-(morpholin-4-yl)propyl]-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 297.31 |
| Molecular Formula: | C12 H19 N5 O4 |
| Smiles: | Cn1c(C(NCCCN2CCOCC2)=O)c(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.7551 |
| logD: | -1.1433 |
| logSw: | -1.2447 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.981 |
| InChI Key: | PPADCZCVKICDID-UHFFFAOYSA-N |