N-[(2-chlorophenyl)methyl]-3-{1-[2-(2,6-dimethylanilino)-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-(2,6-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
N-[(2-chlorophenyl)methyl]-3-{1-[2-(2,6-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Compound characteristics
| Compound ID: | C241-2077 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-3-{1-[2-(2,6-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide |
| Molecular Weight: | 525.03 |
| Molecular Formula: | C26 H25 Cl N4 O4 S |
| Smiles: | Cc1cccc(C)c1NC(CN1C(N(CCC(NCc2ccccc2[Cl])=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1829 |
| logD: | 4.1829 |
| logSw: | -4.2955 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.489 |
| InChI Key: | ARLOQRQBSZFSPO-UHFFFAOYSA-N |