4-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(furan-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(furan-2-yl)methyl]butanamide
4-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(furan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | C241-1458 |
| Compound Name: | 4-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(furan-2-yl)methyl]butanamide |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C24 H30 N4 O5 S |
| Smiles: | CN(C1CCCCC1)C(CN1C(N(CCCC(NCc2ccco2)=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.444 |
| logD: | 2.444 |
| logSw: | -2.6947 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.43 |
| InChI Key: | HQISHNYGOXBRHL-UHFFFAOYSA-N |