ethyl 5-acetyl-4-methyl-2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-4-methyl-2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]thiophene-3-carboxylate
ethyl 5-acetyl-4-methyl-2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8015-6776 |
| Compound Name: | ethyl 5-acetyl-4-methyl-2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]thiophene-3-carboxylate |
| Molecular Weight: | 394.4 |
| Molecular Formula: | C16 H18 N4 O6 S |
| Smiles: | CCOC(c1c(C)c(C(C)=O)sc1NC(C(C)n1cc(cn1)[N+]([O-])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5275 |
| logD: | -1.4444 |
| logSw: | -2.4 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.667 |
| InChI Key: | OZSLUUQIBADTBR-VIFPVBQESA-N |