2-[3-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[3-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-fluorophenyl)acetamide
2-[3-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | C241-1654 |
| Compound Name: | 2-[3-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 540.57 |
| Molecular Formula: | C26 H25 F N4 O6 S |
| Smiles: | COc1ccc(CCNC(CN2C(c3c(ccs3)N(CC(Nc3ccc(cc3)F)=O)C2=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.323 |
| logD: | 2.3229 |
| logSw: | -3.0394 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.008 |
| InChI Key: | RRBGHFIFFLUJMF-UHFFFAOYSA-N |