6-{1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(2-chlorophenyl)methyl]hexanamide
Chemical Structure Depiction of
6-{1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(2-chlorophenyl)methyl]hexanamide
6-{1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(2-chlorophenyl)methyl]hexanamide
Compound characteristics
| Compound ID: | C241-1664 |
| Compound Name: | 6-{1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(2-chlorophenyl)methyl]hexanamide |
| Molecular Weight: | 603.52 |
| Molecular Formula: | C28 H28 Cl2 N4 O5 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CN1C(N(CCCCCC(NCc2ccccc2[Cl])=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2657 |
| logD: | 5.2655 |
| logSw: | -5.7121 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.515 |
| InChI Key: | UVVIUHQZUCMPKG-UHFFFAOYSA-N |