N-[(furan-2-yl)methyl]-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide
N-[(furan-2-yl)methyl]-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C226-4107 |
| Compound Name: | N-[(furan-2-yl)methyl]-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 296.3 |
| Molecular Formula: | C11 H12 N4 O4 S |
| Smiles: | Cc1c(c([nH]n1)SCC(NCc1ccco1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.6372 |
| logD: | 1.6267 |
| logSw: | -2.3458 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.437 |
| InChI Key: | ULOIMDZAPAVKMK-UHFFFAOYSA-N |