N-[2-(4-methoxyphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-phenoxypropanamide
Chemical Structure Depiction of
N-[2-(4-methoxyphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-phenoxypropanamide
N-[2-(4-methoxyphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-phenoxypropanamide
Compound characteristics
Compound ID: | K410-0708 |
Compound Name: | N-[2-(4-methoxyphenyl)-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl]-2-phenoxypropanamide |
Molecular Weight: | 427.48 |
Molecular Formula: | C21 H21 N3 O5 S |
Smiles: | CC(C(Nc1c2CS(Cc2nn1c1ccc(cc1)OC)(=O)=O)=O)Oc1ccccc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.3224 |
logD: | 2.3223 |
logSw: | -2.8009 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.034 |
InChI Key: | ZGRFVVJFGSJELB-AWEZNQCLSA-N |