N-(3-chloro-4-methoxyphenyl)-2-{5,6-dimethyl-2,4-dioxo-3-[3-(trifluoromethyl)phenyl]-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-{5,6-dimethyl-2,4-dioxo-3-[3-(trifluoromethyl)phenyl]-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl}acetamide
N-(3-chloro-4-methoxyphenyl)-2-{5,6-dimethyl-2,4-dioxo-3-[3-(trifluoromethyl)phenyl]-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl}acetamide
Compound characteristics
| Compound ID: | C242-1113 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-{5,6-dimethyl-2,4-dioxo-3-[3-(trifluoromethyl)phenyl]-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl}acetamide |
| Molecular Weight: | 537.94 |
| Molecular Formula: | C24 H19 Cl F3 N3 O4 S |
| Smiles: | Cc1c2C(N(C(N(CC(Nc3ccc(c(c3)[Cl])OC)=O)c2sc1C)=O)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3722 |
| logD: | 5.372 |
| logSw: | -6.2059 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.887 |
| InChI Key: | FCKIZTVQSWPNPK-UHFFFAOYSA-N |