N-tert-butyl-3-fluoro-N-{2-[1-(4-nitrophenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}benzamide
Chemical Structure Depiction of
N-tert-butyl-3-fluoro-N-{2-[1-(4-nitrophenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}benzamide
N-tert-butyl-3-fluoro-N-{2-[1-(4-nitrophenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}benzamide
Compound characteristics
| Compound ID: | V009-8112 |
| Compound Name: | N-tert-butyl-3-fluoro-N-{2-[1-(4-nitrophenyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2(1H)-yl]-2-oxoethyl}benzamide |
| Molecular Weight: | 478.52 |
| Molecular Formula: | C26 H27 F N4 O4 |
| Smiles: | CC(C)(C)N(CC(N1CCn2cccc2C1c1ccc(cc1)[N+]([O-])=O)=O)C(c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2049 |
| logD: | 4.2049 |
| logSw: | -4.3527 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.804 |
| InChI Key: | WRRRXAJRRQGZFF-XMMPIXPASA-N |