methyl 1-ethyl-4-{3-[2-(4-fluorophenyl)acetamido]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-4-{3-[2-(4-fluorophenyl)acetamido]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 1-ethyl-4-{3-[2-(4-fluorophenyl)acetamido]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V025-9858 |
| Compound Name: | methyl 1-ethyl-4-{3-[2-(4-fluorophenyl)acetamido]phenyl}-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 441.52 |
| Molecular Formula: | C23 H24 F N3 O3 S |
| Salt: | not_available |
| Smiles: | CCN1C(C)=C(C(c2cccc(c2)NC(Cc2ccc(cc2)F)=O)NC1=S)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5152 |
| logD: | 3.5151 |
| logSw: | -3.7169 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.523 |
| InChI Key: | VYVXKCJKUQRKKK-OAQYLSRUSA-N |