prop-2-en-1-yl 7-methyl-3-(2-oxo-2-{[(pyridin-4-yl)methyl]amino}ethyl)-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 7-methyl-3-(2-oxo-2-{[(pyridin-4-yl)methyl]amino}ethyl)-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
prop-2-en-1-yl 7-methyl-3-(2-oxo-2-{[(pyridin-4-yl)methyl]amino}ethyl)-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-9847 |
| Compound Name: | prop-2-en-1-yl 7-methyl-3-(2-oxo-2-{[(pyridin-4-yl)methyl]amino}ethyl)-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 502.64 |
| Molecular Formula: | C28 H30 N4 O3 S |
| Smiles: | CC(C)c1ccc(cc1)C1C(=C(C)N=C2N1C(CC(NCc1ccncc1)=O)=CS2)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0226 |
| logD: | 4.0193 |
| logSw: | -4.0224 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.332 |
| InChI Key: | KNGMWQZKSYPDJC-AREMUKBSSA-N |