N-[1-benzyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-chlorobenzamide
Chemical Structure Depiction of
N-[1-benzyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-chlorobenzamide
N-[1-benzyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-chlorobenzamide
Compound characteristics
| Compound ID: | 8016-5938 |
| Compound Name: | N-[1-benzyl-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-4-chlorobenzamide |
| Molecular Weight: | 478.81 |
| Molecular Formula: | C21 H14 Cl F3 N4 O4 |
| Smiles: | C(c1ccccc1)N1C2=C(C(NC1=O)=O)C(C(N2)=O)(C(F)(F)F)NC(c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2787 |
| logD: | -1.1671 |
| logSw: | -3.8788 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.214 |
| InChI Key: | UVYGBEMHXMDIOW-FQEVSTJZSA-N |