2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N,N-diethylacetamide
Chemical Structure Depiction of
2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N,N-diethylacetamide
2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N,N-diethylacetamide
Compound characteristics
| Compound ID: | C241-1931 |
| Compound Name: | 2-[3-{4-[2-(benzylamino)-2-oxoethyl]phenyl}-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N,N-diethylacetamide |
| Molecular Weight: | 504.61 |
| Molecular Formula: | C27 H28 N4 O4 S |
| Smiles: | CCN(CC)C(CN1C(N(C(c2c1ccs2)=O)c1ccc(CC(NCc2ccccc2)=O)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5074 |
| logD: | 2.5074 |
| logSw: | -2.6999 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.55 |
| InChI Key: | CCBKZJGDCROXJV-UHFFFAOYSA-N |