2-methyl-1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)propan-1-one
Chemical Structure Depiction of
2-methyl-1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)propan-1-one
2-methyl-1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | V005-9766 |
| Compound Name: | 2-methyl-1-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)propan-1-one |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C26 H29 N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)C(N1CCN(CC1)c1c(Cc2ccc(cc2)[N+]([O-])=O)c(C)nc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.798 |
| logD: | 5.7228 |
| logSw: | -5.5689 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.338 |
| InChI Key: | MDKLFZUQRHEIDL-UHFFFAOYSA-N |