benzyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-(thiophen-2-yl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-(thiophen-2-yl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-(thiophen-2-yl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-5163 |
| Compound Name: | benzyl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-(thiophen-2-yl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 533.64 |
| Molecular Formula: | C28 H24 F N3 O3 S2 |
| Smiles: | CC1=C(C(c2cccs2)N2C(CC(NCc3ccc(cc3)F)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7637 |
| logD: | 4.7634 |
| logSw: | -4.8529 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.732 |
| InChI Key: | KAMRJFLBYCBNHL-AREMUKBSSA-N |