prop-2-en-1-yl 6-methyl-4-[4-(propan-2-yl)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 6-methyl-4-[4-(propan-2-yl)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
prop-2-en-1-yl 6-methyl-4-[4-(propan-2-yl)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | Y070-0942 |
| Compound Name: | prop-2-en-1-yl 6-methyl-4-[4-(propan-2-yl)phenyl]-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 330.45 |
| Molecular Formula: | C18 H22 N2 O2 S |
| Smiles: | CC(C)c1ccc(cc1)C1C(=C(C)NC(N1)=S)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6487 |
| logD: | 3.6398 |
| logSw: | -3.9141 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.722 |
| InChI Key: | NRTQYUICYSGNQR-MRXNPFEDSA-N |