methyl 5-(4-bromophenyl)-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-7-carboxylate
Chemical Structure Depiction of
methyl 5-(4-bromophenyl)-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-7-carboxylate
methyl 5-(4-bromophenyl)-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-7-carboxylate
Compound characteristics
| Compound ID: | D029-0026 |
| Compound Name: | methyl 5-(4-bromophenyl)-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-7-carboxylate |
| Molecular Weight: | 390.19 |
| Molecular Formula: | C16 H12 Br N3 O4 |
| Smiles: | CN1C(NC(c2c(cc(C(=O)OC)nc12)c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3976 |
| logD: | 3.3952 |
| logSw: | -4.0942 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.056 |
| InChI Key: | XSXALDDFSNUSCW-UHFFFAOYSA-N |