4-({1-[2-(3-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide
Chemical Structure Depiction of
4-({1-[2-(3-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide
4-({1-[2-(3-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G346-0139 |
| Compound Name: | 4-({1-[2-(3-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide |
| Molecular Weight: | 484.57 |
| Molecular Formula: | C24 H28 N4 O5 S |
| Smiles: | CNC(C1CCC(CC1)CN1C(c2c(ccs2)N(CC(Nc2cccc(c2)OC)=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3888 |
| logD: | 3.3888 |
| logSw: | -3.8502 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.006 |
| InChI Key: | MYCLFLKSULFSKP-UHFFFAOYSA-N |