benzyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-(2-oxo-2-{[2-(pyridin-2-yl)ethyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-(2-oxo-2-{[2-(pyridin-2-yl)ethyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-(2-oxo-2-{[2-(pyridin-2-yl)ethyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V020-1072 |
| Compound Name: | benzyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-(2-oxo-2-{[2-(pyridin-2-yl)ethyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 584.69 |
| Molecular Formula: | C32 H32 N4 O5 S |
| Salt: | not_available |
| Smiles: | CC1=C(C(c2cccc(c2OC)OC)N2C(CC(NCCc3ccccn3)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8437 |
| logD: | 3.8389 |
| logSw: | -4.1741 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.446 |
| InChI Key: | UUIVQDIKMQMLCY-GDLZYMKVSA-N |