N-benzyl-4-{1-[2-(2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}butanamide
Chemical Structure Depiction of
N-benzyl-4-{1-[2-(2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}butanamide
N-benzyl-4-{1-[2-(2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}butanamide
Compound characteristics
Compound ID: | C241-2100 |
Compound Name: | N-benzyl-4-{1-[2-(2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}butanamide |
Molecular Weight: | 490.58 |
Molecular Formula: | C26 H26 N4 O4 S |
Smiles: | Cc1ccccc1NC(CN1C(N(CCCC(NCc2ccccc2)=O)C(c2c1ccs2)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.7579 |
logD: | 2.7579 |
logSw: | -3.0847 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 79.187 |
InChI Key: | UKVJIMVSZDDENG-UHFFFAOYSA-N |