methyl 5-(3-fluorophenyl)-7-methyl-3-(2-oxo-2-{[2-(thiophen-2-yl)ethyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-(3-fluorophenyl)-7-methyl-3-(2-oxo-2-{[2-(thiophen-2-yl)ethyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(3-fluorophenyl)-7-methyl-3-(2-oxo-2-{[2-(thiophen-2-yl)ethyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V005-7375 |
| Compound Name: | methyl 5-(3-fluorophenyl)-7-methyl-3-(2-oxo-2-{[2-(thiophen-2-yl)ethyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 471.57 |
| Molecular Formula: | C23 H22 F N3 O3 S2 |
| Smiles: | CC1=C(C(c2cccc(c2)F)N2C(CC(NCCc3cccs3)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4158 |
| logD: | 3.4152 |
| logSw: | -3.7332 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.89 |
| InChI Key: | RSZUWBULNZLYNU-OAQYLSRUSA-N |