N-[(2-chlorophenyl)methyl]-6-[1-{2-[cyclohexyl(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-[cyclohexyl(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-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide
Compound characteristics
| Compound ID: | C241-1588 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-6-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide |
| Molecular Weight: | 559.13 |
| Molecular Formula: | C28 H35 Cl N4 O4 S |
| Smiles: | CN(C1CCCCC1)C(CN1C(N(CCCCCC(NCc2ccccc2[Cl])=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4854 |
| logD: | 4.4854 |
| logSw: | -4.3334 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.681 |
| InChI Key: | LYAUHRBGKDSMHI-UHFFFAOYSA-N |