methyl 6-[(5-chloro-2-methoxybenzene-1-sulfonyl)methyl]-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 6-[(5-chloro-2-methoxybenzene-1-sulfonyl)methyl]-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 6-[(5-chloro-2-methoxybenzene-1-sulfonyl)methyl]-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C653-0463 |
| Compound Name: | methyl 6-[(5-chloro-2-methoxybenzene-1-sulfonyl)methyl]-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 494.95 |
| Molecular Formula: | C22 H23 Cl N2 O7 S |
| Smiles: | CCOc1ccc(cc1)C1C(=C(CS(c2cc(ccc2OC)[Cl])(=O)=O)NC(N1)=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7929 |
| logD: | 2.3671 |
| logSw: | -3.6662 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.991 |
| InChI Key: | DAXUVOUGSNNTCL-HXUWFJFHSA-N |