ethyl 2-{[(4-bromophenyl)methyl]sulfanyl}-4-(2-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(4-bromophenyl)methyl]sulfanyl}-4-(2-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate
ethyl 2-{[(4-bromophenyl)methyl]sulfanyl}-4-(2-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8009-9432 |
| Compound Name: | ethyl 2-{[(4-bromophenyl)methyl]sulfanyl}-4-(2-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate |
| Molecular Weight: | 475.4 |
| Molecular Formula: | C22 H23 Br N2 O3 S |
| Smiles: | CCOC(C1C(c2ccccc2OC)N=C(NC=1C)SCc1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4819 |
| logD: | 4.1546 |
| logSw: | -5.3803 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.456 |
| InChI Key: | GRLVRJCECHLWPM-FQEVSTJZSA-N |