3-benzyl-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-N,N-diethyl-5-methyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-benzyl-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-N,N-diethyl-5-methyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
3-benzyl-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-N,N-diethyl-5-methyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | K305-0267 |
Compound Name: | 3-benzyl-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-N,N-diethyl-5-methyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
Molecular Weight: | 564.66 |
Molecular Formula: | C29 H32 N4 O6 S |
Smiles: | CCN(CC)C(c1c(C)c2C(N(Cc3ccccc3)C(N(CC(Nc3ccc(cc3OC)OC)=O)c2s1)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.0527 |
logD: | 4.0527 |
logSw: | -4.2366 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 85.276 |
InChI Key: | DJGMQPGQRHUVNT-UHFFFAOYSA-N |