4-({1-[2-(3,5-dimethylanilino)-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-(3,5-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide
4-({1-[2-(3,5-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G346-0172 |
| Compound Name: | 4-({1-[2-(3,5-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide |
| Molecular Weight: | 482.6 |
| Molecular Formula: | C25 H30 N4 O4 S |
| Smiles: | Cc1cc(C)cc(c1)NC(CN1C(N(CC2CCC(CC2)C(NC)=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0153 |
| logD: | 4.0153 |
| logSw: | -4.1293 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.462 |
| InChI Key: | XQNMPYLBGPTMQX-UHFFFAOYSA-N |