methyl 7-ethyl-5-(3-methylphenyl)-3-{2-oxo-2-[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-ethyl-5-(3-methylphenyl)-3-{2-oxo-2-[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 7-ethyl-5-(3-methylphenyl)-3-{2-oxo-2-[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V012-5271 |
| Compound Name: | methyl 7-ethyl-5-(3-methylphenyl)-3-{2-oxo-2-[(1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 501.65 |
| Molecular Formula: | C29 H31 N3 O3 S |
| Smiles: | CCC1=C(C(c2cccc(C)c2)N2C(CC(NC3CCCc4ccccc34)=O)=CSC2=N1)C(=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6271 |
| logD: | 5.6256 |
| logSw: | -5.3479 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.481 |
| InChI Key: | IVVXXWJNYNQSFJ-UHFFFAOYSA-N |