N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide
Compound characteristics
| Compound ID: | C172-0284 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)hexanamide |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C20 H21 N3 O5 S |
| Smiles: | C(CCC(NCc1ccc2c(c1)OCO2)=O)CCN1C(c2c(ccs2)NC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5873 |
| logD: | 2.5868 |
| logSw: | -3.1162 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.064 |
| InChI Key: | QUUSERLLSNQWDK-UHFFFAOYSA-N |