prop-2-en-1-yl 5-(2,5-dimethylphenyl)-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
prop-2-en-1-yl 5-(2,5-dimethylphenyl)-7-methyl-3-(2-oxo-2-{[2-(pyridin-2-yl)ethyl]amino}ethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
prop-2-en-1-yl 5-(2,5-dimethylphenyl)-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: | V028-1789 |
| Compound Name: | prop-2-en-1-yl 5-(2,5-dimethylphenyl)-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: | 502.64 |
| Molecular Formula: | C28 H30 N4 O3 S |
| Salt: | not_available |
| Smiles: | CC1=C(C(c2cc(C)ccc2C)N2C(CC(NCCc3ccccn3)=O)=CSC2=N1)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8549 |
| logD: | 3.8501 |
| logSw: | -3.8802 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.289 |
| InChI Key: | RHGNYWBDWNEBRD-AREMUKBSSA-N |