benzyl 3-{2-[3-(ethoxycarbonyl)piperidin-1-yl]-2-oxoethyl}-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 3-{2-[3-(ethoxycarbonyl)piperidin-1-yl]-2-oxoethyl}-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 3-{2-[3-(ethoxycarbonyl)piperidin-1-yl]-2-oxoethyl}-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V003-4593 |
| Compound Name: | benzyl 3-{2-[3-(ethoxycarbonyl)piperidin-1-yl]-2-oxoethyl}-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 601.77 |
| Molecular Formula: | C34 H39 N3 O5 S |
| Smiles: | CCOC(C1CCCN(C1)C(CC1=CSC2=NC(C)=C(C(c3ccc(cc3)C(C)C)N12)C(=O)OCc1ccccc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.092 |
| logD: | 6.0919 |
| logSw: | -5.4342 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.322 |
| InChI Key: | VHPHGHQBYRXORC-UHFFFAOYSA-N |