6-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]hexanamide
Chemical Structure Depiction of
6-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]hexanamide
6-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]hexanamide
Compound characteristics
| Compound ID: | C241-1552 |
| Compound Name: | 6-[1-(2-amino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]hexanamide |
| Molecular Weight: | 472.52 |
| Molecular Formula: | C22 H24 N4 O6 S |
| Smiles: | C(CCC(NCc1ccc2c(c1)OCO2)=O)CCN1C(c2c(ccs2)N(CC(N)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5304 |
| logD: | 1.5304 |
| logSw: | -2.6401 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.51 |
| InChI Key: | PLBZOBZXUHQZMB-UHFFFAOYSA-N |