N-benzyl-4-[(1-methyl-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[(1-methyl-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]cyclohexane-1-carboxamide
N-benzyl-4-[(1-methyl-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G346-0128 |
| Compound Name: | N-benzyl-4-[(1-methyl-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | CN1C(N(CC2CCC(CC2)C(NCc2ccccc2)=O)C(c2c1ccs2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4454 |
| logD: | 3.4454 |
| logSw: | -3.7276 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.928 |
| InChI Key: | OIKFAGOCANJEGP-UHFFFAOYSA-N |