3,4-dimethylcyclohexyl 4-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
3,4-dimethylcyclohexyl 4-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
3,4-dimethylcyclohexyl 4-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 1630-0846 |
| Compound Name: | 3,4-dimethylcyclohexyl 4-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 418.55 |
| Molecular Formula: | C22 H30 N2 O4 S |
| Smiles: | CC1CCC(CC1C)OC(C1C(c2cc(ccc2OC)OC)NC(NC=1C)=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2148 |
| logD: | 4.1987 |
| logSw: | -4.4184 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.932 |
| InChI Key: | FUQKGAWRINVOJB-UHFFFAOYSA-N |