N-[(2-chlorophenyl)methyl]-3-{1-[2-(2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-3-{1-[2-(2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
N-[(2-chlorophenyl)methyl]-3-{1-[2-(2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Compound characteristics
| Compound ID: | C241-2058 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-3-{1-[2-(2-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide |
| Molecular Weight: | 527 |
| Molecular Formula: | C25 H23 Cl N4 O5 S |
| Smiles: | COc1ccccc1NC(CN1C(N(CCC(NCc2ccccc2[Cl])=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7513 |
| logD: | 3.7513 |
| logSw: | -3.9762 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.817 |
| InChI Key: | KYNLAAUJEGKTBM-UHFFFAOYSA-N |