methyl 2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
methyl 2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
Compound ID: | 8015-6126 |
Compound Name: | methyl 2-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
Molecular Weight: | 364.38 |
Molecular Formula: | C15 H16 N4 O5 S |
Smiles: | CC(C(Nc1c(C(=O)OC)c2CCCc2s1)=O)n1cc(cn1)[N+]([O-])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.8698 |
logD: | -0.5724 |
logSw: | -2.4892 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 92.547 |
InChI Key: | UPUDBOFNQAVGIS-QMMMGPOBSA-N |