methyl 4-(3,4-dimethoxyphenyl)-2-oxo-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 4-(3,4-dimethoxyphenyl)-2-oxo-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 4-(3,4-dimethoxyphenyl)-2-oxo-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0358 |
| Compound Name: | methyl 4-(3,4-dimethoxyphenyl)-2-oxo-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 488.56 |
| Molecular Formula: | C24 H28 N2 O7 S |
| Smiles: | Cc1cc(C)c(c(C)c1)S(CC1=C(C(c2ccc(c(c2)OC)OC)NC(N1)=O)C(=O)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1013 |
| logD: | 2.6755 |
| logSw: | -3.329 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.498 |
| InChI Key: | ZSIVRIAROROIKC-OAQYLSRUSA-N |