methyl 4-(3-bromophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Chemical Structure Depiction of
methyl 4-(3-bromophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
methyl 4-(3-bromophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 2017-2407 |
| Compound Name: | methyl 4-(3-bromophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate |
| Molecular Weight: | 324.17 |
| Molecular Formula: | C14 H14 Br N O3 |
| Smiles: | CC1=C(C(CC(N1)=O)c1cccc(c1)[Br])C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4724 |
| logD: | 1.5324 |
| logSw: | -2.9285 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.613 |
| InChI Key: | GJFTWNZUYLMWMG-NSHDSACASA-N |