4-{[1-(2-anilino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]methyl}-N-(propan-2-yl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[1-(2-anilino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]methyl}-N-(propan-2-yl)cyclohexane-1-carboxamide
4-{[1-(2-anilino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]methyl}-N-(propan-2-yl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G346-0327 |
| Compound Name: | 4-{[1-(2-anilino-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]methyl}-N-(propan-2-yl)cyclohexane-1-carboxamide |
| Molecular Weight: | 482.6 |
| Molecular Formula: | C25 H30 N4 O4 S |
| Smiles: | CC(C)NC(C1CCC(CC1)CN1C(c2c(ccs2)N(CC(Nc2ccccc2)=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.934 |
| logD: | 3.9339 |
| logSw: | -3.9978 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.286 |
| InChI Key: | CTGSBVSITZPHGS-UHFFFAOYSA-N |