methyl 2-{[3-(4-fluorophenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}-4,5-dimethoxybenzoate
Chemical Structure Depiction of
methyl 2-{[3-(4-fluorophenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}-4,5-dimethoxybenzoate
methyl 2-{[3-(4-fluorophenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}-4,5-dimethoxybenzoate
Compound characteristics
| Compound ID: | D358-0826 |
| Compound Name: | methyl 2-{[3-(4-fluorophenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carbonyl]amino}-4,5-dimethoxybenzoate |
| Molecular Weight: | 483.47 |
| Molecular Formula: | C23 H18 F N3 O6 S |
| Smiles: | COC(c1cc(c(cc1NC(C1=CN=C2N(C(=CS2)c2ccc(cc2)F)C1=O)=O)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7629 |
| logD: | -2.6045 |
| logSw: | -3.477 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.073 |
| InChI Key: | HTTVIRPUJWRYAK-UHFFFAOYSA-N |