N-[2-(2-chlorophenyl)ethyl]-4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide
Chemical Structure Depiction of
N-[2-(2-chlorophenyl)ethyl]-4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide
N-[2-(2-chlorophenyl)ethyl]-4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide
Compound characteristics
| Compound ID: | C172-0414 |
| Compound Name: | N-[2-(2-chlorophenyl)ethyl]-4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide |
| Molecular Weight: | 391.87 |
| Molecular Formula: | C18 H18 Cl N3 O3 S |
| Smiles: | C(CC(NCCc1ccccc1[Cl])=O)CN1C(c2c(ccs2)NC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2757 |
| logD: | 2.2752 |
| logSw: | -3.1173 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.79 |
| InChI Key: | TWCWPYOVGSHWBC-UHFFFAOYSA-N |