2-[(1-ethyl-1H-pyrazol-5-yl)methylidene]-7-methyl-3-oxo-N-phenyl-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-[(1-ethyl-1H-pyrazol-5-yl)methylidene]-7-methyl-3-oxo-N-phenyl-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
2-[(1-ethyl-1H-pyrazol-5-yl)methylidene]-7-methyl-3-oxo-N-phenyl-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | Y500-3996 |
Compound Name: | 2-[(1-ethyl-1H-pyrazol-5-yl)methylidene]-7-methyl-3-oxo-N-phenyl-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide |
Molecular Weight: | 475.59 |
Molecular Formula: | C24 H21 N5 O2 S2 |
Smiles: | CCn1c(\C=C2/C(N3C(C(=C(C)N=C3S2)C(Nc2ccccc2)=O)c2cccs2)=O)ccn1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.2347 |
logD: | 3.2337 |
logSw: | -3.4569 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.673 |
InChI Key: | YRIGCDUHWDDEQX-OAQYLSRUSA-N |