N-(2-methoxyethyl)-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide
N-(2-methoxyethyl)-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C226-4135 |
| Compound Name: | N-(2-methoxyethyl)-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 274.3 |
| Molecular Formula: | C9 H14 N4 O4 S |
| Smiles: | Cc1c(c([nH]n1)SCC(NCCOC)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.2206 |
| logD: | 0.21 |
| logSw: | -1.3685 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.143 |
| InChI Key: | QUKLPNJROMBCDR-UHFFFAOYSA-N |