N-[1-(4-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-methylbenzamide
Chemical Structure Depiction of
N-[1-(4-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-methylbenzamide
N-[1-(4-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-methylbenzamide
Compound characteristics
| Compound ID: | 6259-7002 |
| Compound Name: | N-[1-(4-chlorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-methylbenzamide |
| Molecular Weight: | 478.81 |
| Molecular Formula: | C21 H14 Cl F3 N4 O4 |
| Smiles: | Cc1cccc(c1)C(NC1(C2=C(NC1=O)N(C(NC2=O)=O)c1ccc(cc1)[Cl])C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1026 |
| logD: | -1.5537 |
| logSw: | -3.6335 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.602 |
| InChI Key: | DIWMHGJNPJJHAC-FQEVSTJZSA-N |