N-{1-[2-(3,4-diethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}furan-2-carboxamide
Chemical Structure Depiction of
N-{1-[2-(3,4-diethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}furan-2-carboxamide
N-{1-[2-(3,4-diethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}furan-2-carboxamide
Compound characteristics
| Compound ID: | 8013-1460 |
| Compound Name: | N-{1-[2-(3,4-diethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}furan-2-carboxamide |
| Molecular Weight: | 536.46 |
| Molecular Formula: | C24 H23 F3 N4 O7 |
| Smiles: | CCOc1ccc(CCN2C3=C(C(NC2=O)=O)C(C(N3)=O)(C(F)(F)F)NC(c2ccco2)=O)cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0639 |
| logD: | -0.9936 |
| logSw: | -2.8853 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.191 |
| InChI Key: | SKUAZLXFAHAXET-QHCPKHFHSA-N |