4-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-benzylbutanamide
Chemical Structure Depiction of
4-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-benzylbutanamide
4-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-benzylbutanamide
Compound characteristics
Compound ID: | C241-2116 |
Compound Name: | 4-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-benzylbutanamide |
Molecular Weight: | 400.45 |
Molecular Formula: | C19 H20 N4 O4 S |
Smiles: | C(CC(NCc1ccccc1)=O)CN1C(c2c(ccs2)N(CC(N)=O)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 0.6072 |
logD: | 0.6072 |
logSw: | -2.0223 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 90.395 |
InChI Key: | IDCHSLKUKCWTLQ-UHFFFAOYSA-N |