N-(3-chlorophenyl)-3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(3-chlorophenyl)-3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K850-0130 |
| Compound Name: | N-(3-chlorophenyl)-3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 512.97 |
| Molecular Formula: | C24 H21 Cl N4 O5 S |
| Smiles: | Cc1c2C(N(CC(Nc3ccc(cc3OC)OC)=O)C=Nc2sc1C(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7014 |
| logD: | 3.6406 |
| logSw: | -4.6582 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.958 |
| InChI Key: | ZSDGIHUYCBZZQJ-UHFFFAOYSA-N |