(4-methyl-3-nitrophenyl)(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
(4-methyl-3-nitrophenyl)(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)methanone
(4-methyl-3-nitrophenyl)(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V011-5745 |
| Compound Name: | (4-methyl-3-nitrophenyl)(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 552.59 |
| Molecular Formula: | C30 H28 N6 O5 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(N1CCN(CC1)c1c(Cc2ccc(cc2)[N+]([O-])=O)c(C)nc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4109 |
| logD: | 6.3357 |
| logSw: | -5.6857 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 105.147 |
| InChI Key: | XYNXZGJIKNEJBI-UHFFFAOYSA-N |