ethyl 5-(4-chlorophenyl)-7-methyl-3-oxo-2-[2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-chlorophenyl)-7-methyl-3-oxo-2-[2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(4-chlorophenyl)-7-methyl-3-oxo-2-[2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 2556-2075 |
| Compound Name: | ethyl 5-(4-chlorophenyl)-7-methyl-3-oxo-2-[2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 520.01 |
| Molecular Formula: | C27 H22 Cl N3 O4 S |
| Smiles: | [H]C1(C(=C(C)N=C2N1C(/C(=C1C(N(CC=C)c3ccccc\13)=O)S2)=O)C(=O)OCC)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7861 |
| logD: | 4.7861 |
| logSw: | -5.0599 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.466 |
| InChI Key: | MLKWHDUYNQSAMQ-QFIPXVFZSA-N |