2-(4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-phenylacetamide
Chemical Structure Depiction of
2-(4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-phenylacetamide
2-(4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-phenylacetamide
Compound characteristics
Compound ID: | C241-2136 |
Compound Name: | 2-(4-{1-[(2-cyanophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}phenyl)-N-phenylacetamide |
Molecular Weight: | 492.56 |
Molecular Formula: | C28 H20 N4 O3 S |
Smiles: | C(C(Nc1ccccc1)=O)c1ccc(cc1)N1C(c2c(ccs2)N(Cc2ccccc2C#N)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1038 |
logD: | 4.1037 |
logSw: | -4.4154 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.608 |
InChI Key: | GAMNIBPKNXHBCF-UHFFFAOYSA-N |