1-butoxy-3-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)propan-2-ol
Chemical Structure Depiction of
1-butoxy-3-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)propan-2-ol
1-butoxy-3-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)propan-2-ol
Compound characteristics
| Compound ID: | V007-9761 |
| Compound Name: | 1-butoxy-3-(4-{6-methyl-5-[(4-nitrophenyl)methyl]-2-phenylpyrimidin-4-yl}piperazin-1-yl)propan-2-ol |
| Molecular Weight: | 519.64 |
| Molecular Formula: | C29 H37 N5 O4 |
| Salt: | not_available |
| Smiles: | CCCCOCC(CN1CCN(CC1)c1c(Cc2ccc(cc2)[N+]([O-])=O)c(C)nc(c2ccccc2)n1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8975 |
| logD: | 5.6122 |
| logSw: | -5.4621 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.395 |
| InChI Key: | TYFSIEXUCGWJNS-SANMLTNESA-N |