N-benzyl-2-[3-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-ethylacetamide
Chemical Structure Depiction of
N-benzyl-2-[3-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-ethylacetamide
N-benzyl-2-[3-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-ethylacetamide
Compound characteristics
Compound ID: | C241-1834 |
Compound Name: | N-benzyl-2-[3-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-ethylacetamide |
Molecular Weight: | 525.03 |
Molecular Formula: | C26 H25 Cl N4 O4 S |
Smiles: | CCN(Cc1ccccc1)C(CN1C(N(CC(NCc2ccccc2[Cl])=O)C(c2c1ccs2)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6834 |
logD: | 3.6834 |
logSw: | -3.8774 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.437 |
InChI Key: | NQWHZGWJLAGVMM-UHFFFAOYSA-N |