dimethyl 5-{[3-(4-fluorophenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[3-(4-fluorophenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[3-(4-fluorophenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | D358-0827 |
| Compound Name: | dimethyl 5-{[3-(4-fluorophenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 481.46 |
| Molecular Formula: | C23 H16 F N3 O6 S |
| Smiles: | COC(c1cc(cc(c1)NC(C1=CN=C2N(C(=CS2)c2ccc(cc2)F)C1=O)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6534 |
| logD: | 2.3279 |
| logSw: | -4.1705 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.683 |
| InChI Key: | IOTHFGIZHVJWRL-UHFFFAOYSA-N |