ethyl 3-{[(2-chloro-6-fluorophenyl)methylidene]amino}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 3-{[(2-chloro-6-fluorophenyl)methylidene]amino}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 3-{[(2-chloro-6-fluorophenyl)methylidene]amino}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K018-0084 |
| Compound Name: | ethyl 3-{[(2-chloro-6-fluorophenyl)methylidene]amino}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 393.82 |
| Molecular Formula: | C17 H13 Cl F N3 O3 S |
| Smiles: | CCOC(c1c(C)c2C(N(C=Nc2s1)/N=C/c1c(cccc1[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4013 |
| logD: | 3.4013 |
| logSw: | -4.1205 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.87 |
| InChI Key: | FUJJJBOOTGJVOB-UHFFFAOYSA-N |