pentyl 6-methyl-4-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
pentyl 6-methyl-4-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
pentyl 6-methyl-4-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 1630-1269 |
| Compound Name: | pentyl 6-methyl-4-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 318.44 |
| Molecular Formula: | C17 H22 N2 O2 S |
| Smiles: | CCCCCOC(C1C(c2ccccc2)NC(NC=1C)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8453 |
| logD: | 3.8293 |
| logSw: | -3.8354 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.722 |
| InChI Key: | MNEKSLBONSYGKJ-OAHLLOKOSA-N |