N-[(2-chlorophenyl)methyl]-4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide
N-[(2-chlorophenyl)methyl]-4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide
Compound characteristics
| Compound ID: | C172-0473 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide |
| Molecular Weight: | 377.85 |
| Molecular Formula: | C17 H16 Cl N3 O3 S |
| Smiles: | C(CC(NCc1ccccc1[Cl])=O)CN1C(c2c(ccs2)NC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4461 |
| logD: | 2.4456 |
| logSw: | -3.1835 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.949 |
| InChI Key: | BSMLGFQRVSCOFQ-UHFFFAOYSA-N |