N-[4-(4-bromophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-[4-(4-bromophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]-3,4,5-trimethoxybenzamide
N-[4-(4-bromophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]-3,4,5-trimethoxybenzamide
Compound characteristics
Compound ID: | E600-0600 |
Compound Name: | N-[4-(4-bromophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]-3,4,5-trimethoxybenzamide |
Molecular Weight: | 462.3 |
Molecular Formula: | C20 H20 Br N3 O5 |
Smiles: | COc1cc(cc(c1OC)OC)C(NC1NC(CC(c2ccc(cc2)[Br])N=1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9257 |
logD: | 2.9242 |
logSw: | -3.405 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 82.212 |
InChI Key: | HWDYRXLQYIEKMX-AWEZNQCLSA-N |