methyl 4-[3-(2-bromobenzamido)phenyl]-1-butyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 4-[3-(2-bromobenzamido)phenyl]-1-butyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 4-[3-(2-bromobenzamido)phenyl]-1-butyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V013-7253 |
| Compound Name: | methyl 4-[3-(2-bromobenzamido)phenyl]-1-butyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 500.39 |
| Molecular Formula: | C24 H26 Br N3 O4 |
| Smiles: | CCCCN1C(C)=C(C(c2cccc(c2)NC(c2ccccc2[Br])=O)NC1=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4557 |
| logD: | 4.4541 |
| logSw: | -4.2191 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.153 |
| InChI Key: | SSUVCODSEZMHIO-NRFANRHFSA-N |