N-[4-(4-bromophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]-4-butoxybenzamide
Chemical Structure Depiction of
N-[4-(4-bromophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]-4-butoxybenzamide
N-[4-(4-bromophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]-4-butoxybenzamide
Compound characteristics
| Compound ID: | E600-0591 |
| Compound Name: | N-[4-(4-bromophenyl)-6-oxo-1,4,5,6-tetrahydropyrimidin-2-yl]-4-butoxybenzamide |
| Molecular Weight: | 444.33 |
| Molecular Formula: | C21 H22 Br N3 O3 |
| Smiles: | CCCCOc1ccc(cc1)C(NC1NC(CC(c2ccc(cc2)[Br])N=1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5773 |
| logD: | 4.5576 |
| logSw: | -4.2049 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.651 |
| InChI Key: | QITGSNFWELVYQO-SFHVURJKSA-N |