methyl 7-ethyl-3-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-ethyl-3-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 7-ethyl-3-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V020-0335 |
| Compound Name: | methyl 7-ethyl-3-{2-oxo-2-[(1-phenylethyl)amino]ethyl}-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 503.66 |
| Molecular Formula: | C29 H33 N3 O3 S |
| Smiles: | CCC1=C(C(c2ccc(cc2)C(C)C)N2C(CC(NC(C)c3ccccc3)=O)=CSC2=N1)C(=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7067 |
| logD: | 5.7052 |
| logSw: | -5.4886 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.8 |
| InChI Key: | ADNDVBAGBHOZAT-UHFFFAOYSA-N |