3-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(4-methoxyphenyl)methyl]propanamide
Chemical Structure Depiction of
3-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(4-methoxyphenyl)methyl]propanamide
3-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(4-methoxyphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | C241-1514 |
| Compound Name: | 3-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(4-methoxyphenyl)methyl]propanamide |
| Molecular Weight: | 512.63 |
| Molecular Formula: | C26 H32 N4 O5 S |
| Smiles: | CN(C1CCCCC1)C(CN1C(N(CCC(NCc2ccc(cc2)OC)=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9289 |
| logD: | 2.9289 |
| logSw: | -3.363 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.225 |
| InChI Key: | PFCIBOMREAFRRC-UHFFFAOYSA-N |