methyl 3-[2-(3-methoxyanilino)-2-oxoethyl]-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(3-methoxyanilino)-2-oxoethyl]-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 3-[2-(3-methoxyanilino)-2-oxoethyl]-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V012-2783 |
| Compound Name: | methyl 3-[2-(3-methoxyanilino)-2-oxoethyl]-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 491.61 |
| Molecular Formula: | C27 H29 N3 O4 S |
| Smiles: | CC(C)c1ccc(cc1)C1C(=C(C)N=C2N1C(CC(Nc1cccc(c1)OC)=O)=CS2)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3383 |
| logD: | 5.3377 |
| logSw: | -5.3928 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.252 |
| InChI Key: | INOVNFNPBNOECR-VWLOTQADSA-N |