6-[1-{2-[(butan-2-yl)amino]-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-[(butan-2-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(2-chlorophenyl)methyl]hexanamide
6-[1-{2-[(butan-2-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(2-chlorophenyl)methyl]hexanamide
Compound characteristics
| Compound ID: | C241-1612 |
| Compound Name: | 6-[1-{2-[(butan-2-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(2-chlorophenyl)methyl]hexanamide |
| Molecular Weight: | 519.06 |
| Molecular Formula: | C25 H31 Cl N4 O4 S |
| Smiles: | CCC(C)NC(CN1C(N(CCCCCC(NCc2ccccc2[Cl])=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8054 |
| logD: | 3.8054 |
| logSw: | -4.087 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.92 |
| InChI Key: | MSBAYHIITMNUGA-KRWDZBQOSA-N |