2-[3-(3-chloro-4-fluorophenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-[3-(3-chloro-4-fluorophenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-[3-(3-chloro-4-fluorophenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | C241-1113 |
| Compound Name: | 2-[3-(3-chloro-4-fluorophenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 517.96 |
| Molecular Formula: | C24 H21 Cl F N3 O5 S |
| Smiles: | COc1ccc(CCNC(CN2C(N(C(c3c2ccs3)=O)c2ccc(c(c2)[Cl])F)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.7805 |
| logD: | 2.7805 |
| logSw: | -3.5128 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.247 |
| InChI Key: | BNDCTYDZFOZBQP-UHFFFAOYSA-N |