N-butyl-3-[2-(2-methoxyanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-butyl-3-[2-(2-methoxyanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-butyl-3-[2-(2-methoxyanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K850-0231 |
| Compound Name: | N-butyl-3-[2-(2-methoxyanilino)-2-oxoethyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C21 H24 N4 O4 S |
| Smiles: | CCCCNC(c1c(C)c2C(N(CC(Nc3ccccc3OC)=O)C=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5655 |
| logD: | 2.5654 |
| logSw: | -2.9112 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.85 |
| InChI Key: | QXAAEHZPNMAUNY-UHFFFAOYSA-N |