3-methyl-N-{2,4,6-trioxo-1-[(pyridin-3-yl)methyl]-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}benzamide
Chemical Structure Depiction of
3-methyl-N-{2,4,6-trioxo-1-[(pyridin-3-yl)methyl]-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}benzamide
3-methyl-N-{2,4,6-trioxo-1-[(pyridin-3-yl)methyl]-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}benzamide
Compound characteristics
| Compound ID: | 8019-1675 |
| Compound Name: | 3-methyl-N-{2,4,6-trioxo-1-[(pyridin-3-yl)methyl]-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}benzamide |
| Molecular Weight: | 459.38 |
| Molecular Formula: | C21 H16 F3 N5 O4 |
| Smiles: | Cc1cccc(c1)C(NC1(C2=C(NC1=O)N(Cc1cccnc1)C(NC2=O)=O)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7419 |
| logD: | -2.3025 |
| logSw: | -1.7696 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.731 |
| InChI Key: | BPWSRYVGIDEEAK-FQEVSTJZSA-N |