methyl 6-methyl-4-[4-(methylsulfanyl)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 6-methyl-4-[4-(methylsulfanyl)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 6-methyl-4-[4-(methylsulfanyl)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 4896-4197 |
| Compound Name: | methyl 6-methyl-4-[4-(methylsulfanyl)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 308.42 |
| Molecular Formula: | C14 H16 N2 O2 S2 |
| Smiles: | CC1=C(C(c2ccc(cc2)SC)NC(N1)=S)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5849 |
| logD: | 2.5689 |
| logSw: | -3.0291 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.848 |
| InChI Key: | UHGMKNGOCVXMRZ-GFCCVEGCSA-N |