methyl 1-ethyl-6-methyl-4-[4-(2-phenoxyacetamido)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-6-methyl-4-[4-(2-phenoxyacetamido)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 1-ethyl-6-methyl-4-[4-(2-phenoxyacetamido)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V017-0317 |
| Compound Name: | methyl 1-ethyl-6-methyl-4-[4-(2-phenoxyacetamido)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C23 H25 N3 O4 S |
| Smiles: | CCN1C(C)=C(C(c2ccc(cc2)NC(COc2ccccc2)=O)NC1=S)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3825 |
| logD: | 3.3825 |
| logSw: | -3.6596 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.022 |
| InChI Key: | ARAUOYQHTUVWNQ-OAQYLSRUSA-N |