N-[2-(4-chlorophenyl)ethyl]-3-[2,4-dioxo-1-(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]propanamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-3-[2,4-dioxo-1-(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]propanamide
N-[2-(4-chlorophenyl)ethyl]-3-[2,4-dioxo-1-(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]propanamide
Compound characteristics
| Compound ID: | C241-2164 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-3-[2,4-dioxo-1-(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]propanamide |
| Molecular Weight: | 519.02 |
| Molecular Formula: | C24 H27 Cl N4 O5 S |
| Smiles: | C1CC(CNC(CN2C(N(CCC(NCCc3ccc(cc3)[Cl])=O)C(c3c2ccs3)=O)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6189 |
| logD: | 1.6189 |
| logSw: | -2.8698 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.702 |
| InChI Key: | VCMZITAZWGWRMV-GOSISDBHSA-N |