4-({1-[2-(benzylamino)-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-(benzylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide
4-({1-[2-(benzylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G346-0132 |
| Compound Name: | 4-({1-[2-(benzylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C24 H28 N4 O4 S |
| Smiles: | CNC(C1CCC(CC1)CN1C(c2c(ccs2)N(CC(NCc2ccccc2)=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9001 |
| logD: | 2.9001 |
| logSw: | -3.3144 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.784 |
| InChI Key: | MMTAPYBKSHGRHU-UHFFFAOYSA-N |