ethyl 6-methyl-4-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-1,4-dihydropyrimidine-5-carboxylate--hydrogen bromide (1/1)
Chemical Structure Depiction of
ethyl 6-methyl-4-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-1,4-dihydropyrimidine-5-carboxylate--hydrogen bromide (1/1)
ethyl 6-methyl-4-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-1,4-dihydropyrimidine-5-carboxylate--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8012-6430 |
| Compound Name: | ethyl 6-methyl-4-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-1,4-dihydropyrimidine-5-carboxylate--hydrogen bromide (1/1) |
| Molecular Weight: | 397.33 |
| Molecular Formula: | C17 H20 N2 O2 S |
| Salt: | HBr |
| Smiles: | CCOC(C1C(c2ccccc2)N=C(NC=1C)SCC=C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0949 |
| logD: | 2.4575 |
| logSw: | -4.004 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.097 |
| InChI Key: | AHHZEFFRIXWKGH-HNNXBMFYSA-N |