methyl 7-methyl-3-oxo-2-(3-phenylprop-2-en-1-ylidene)-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-methyl-3-oxo-2-(3-phenylprop-2-en-1-ylidene)-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 7-methyl-3-oxo-2-(3-phenylprop-2-en-1-ylidene)-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 2388-1058 |
| Compound Name: | methyl 7-methyl-3-oxo-2-(3-phenylprop-2-en-1-ylidene)-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C22 H18 N2 O3 S2 |
| Smiles: | [H]C1(C(=C(C)N=C2N1C(/C(=C\C=C\c1ccccc1)S2)=O)C(=O)OC)c1cccs1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2666 |
| logD: | 4.2666 |
| logSw: | -4.3862 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.186 |
| InChI Key: | DOXFZFMZOSOEDP-LJQANCHMSA-N |