2-methoxyethyl 4-{3-[2-(4-fluorophenyl)acetamido]phenyl}-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2-methoxyethyl 4-{3-[2-(4-fluorophenyl)acetamido]phenyl}-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2-methoxyethyl 4-{3-[2-(4-fluorophenyl)acetamido]phenyl}-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V014-9997 |
| Compound Name: | 2-methoxyethyl 4-{3-[2-(4-fluorophenyl)acetamido]phenyl}-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 471.55 |
| Molecular Formula: | C24 H26 F N3 O4 S |
| Smiles: | CC1=C(C(c2cccc(c2)NC(Cc2ccc(cc2)F)=O)NC(N1C)=S)C(=O)OCCOC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4938 |
| logD: | 2.4935 |
| logSw: | -2.9765 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.781 |
| InChI Key: | KMWYEOKFUBELTE-JOCHJYFZSA-N |