2-{1-[(3-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{1-[(3-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-{1-[(3-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | C241-1632 |
| Compound Name: | 2-{1-[(3-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 514 |
| Molecular Formula: | C25 H24 Cl N3 O5 S |
| Smiles: | COc1ccc(CCNC(CN2C(c3c(ccs3)N(Cc3cccc(c3)[Cl])C2=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.5435 |
| logD: | 3.5435 |
| logSw: | -3.8526 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.859 |
| InChI Key: | YNNUVIQYVLCGCD-UHFFFAOYSA-N |