prop-2-en-1-yl 4-{4-[(furan-2-carbonyl)oxy]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 4-{4-[(furan-2-carbonyl)oxy]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
prop-2-en-1-yl 4-{4-[(furan-2-carbonyl)oxy]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | Y070-0932 |
| Compound Name: | prop-2-en-1-yl 4-{4-[(furan-2-carbonyl)oxy]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 398.44 |
| Molecular Formula: | C20 H18 N2 O5 S |
| Smiles: | CC1=C(C(c2ccc(cc2)OC(c2ccco2)=O)NC(N1)=S)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.533 |
| logD: | 2.524 |
| logSw: | -2.9035 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.678 |
| InChI Key: | QRGOQPYYTVMAKX-QGZVFWFLSA-N |