(furan-2-yl)(4-{6-methyl-5-[(2-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
(furan-2-yl)(4-{6-methyl-5-[(2-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)methanone
(furan-2-yl)(4-{6-methyl-5-[(2-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V004-9867 |
| Compound Name: | (furan-2-yl)(4-{6-methyl-5-[(2-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 483.53 |
| Molecular Formula: | C27 H25 N5 O4 |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccccc2[N+]([O-])=O)c(nc(c2ccccc2)n1)N1CCN(CC1)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6582 |
| logD: | 5.5831 |
| logSw: | -5.5695 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.344 |
| InChI Key: | WADQKUOVHAJDGX-UHFFFAOYSA-N |