N-[(2-chlorophenyl)methyl]-3-{2,4-dioxo-1-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-3-{2,4-dioxo-1-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
N-[(2-chlorophenyl)methyl]-3-{2,4-dioxo-1-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide
Compound characteristics
Compound ID: | C241-2073 |
Compound Name: | N-[(2-chlorophenyl)methyl]-3-{2,4-dioxo-1-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}propanamide |
Molecular Weight: | 539.05 |
Molecular Formula: | C27 H27 Cl N4 O4 S |
Smiles: | Cc1cc(C)c(c(C)c1)NC(CN1C(N(CCC(NCc2ccccc2[Cl])=O)C(c2c1ccs2)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5115 |
logD: | 4.5115 |
logSw: | -4.4582 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.489 |
InChI Key: | IZXUILKMGVIKAE-UHFFFAOYSA-N |