N-[(2-chlorophenyl)methyl]-6-[1-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-6-[1-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide
N-[(2-chlorophenyl)methyl]-6-[1-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide
Compound characteristics
| Compound ID: | C241-1661 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-6-[1-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide |
| Molecular Weight: | 587.52 |
| Molecular Formula: | C28 H28 Cl2 N4 O4 S |
| Smiles: | C(CCC(NCc1ccccc1[Cl])=O)CCN1C(c2c(ccs2)N(CC(NCc2ccccc2[Cl])=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1149 |
| logD: | 5.1149 |
| logSw: | -5.5308 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.206 |
| InChI Key: | YOTRFKPYLYVFJT-UHFFFAOYSA-N |