(furan-2-yl)(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-(propan-2-yl)pyrimidin-4-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
(furan-2-yl)(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-(propan-2-yl)pyrimidin-4-yl}piperazin-1-yl)methanone
(furan-2-yl)(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-(propan-2-yl)pyrimidin-4-yl}piperazin-1-yl)methanone
Compound characteristics
Compound ID: | V005-4501 |
Compound Name: | (furan-2-yl)(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-(propan-2-yl)pyrimidin-4-yl}piperazin-1-yl)methanone |
Molecular Weight: | 449.51 |
Molecular Formula: | C24 H27 N5 O4 |
Salt: | not_available |
Smiles: | CC(C)c1nc(C)c(Cc2ccc(cc2)[N+]([O-])=O)c(n1)N1CCN(CC1)C(c1ccco1)=O |
Stereo: | ACHIRAL |
logP: | 4.4457 |
logD: | 4.3112 |
logSw: | -4.3795 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 80.916 |
InChI Key: | DQFILKBSHRHUHN-UHFFFAOYSA-N |