4-bromo-3,5-bis(4-methylphenyl)-1-[(4-nitro-1H-pyrazol-1-yl)methyl]-1H-pyrazole
Chemical Structure Depiction of
4-bromo-3,5-bis(4-methylphenyl)-1-[(4-nitro-1H-pyrazol-1-yl)methyl]-1H-pyrazole
4-bromo-3,5-bis(4-methylphenyl)-1-[(4-nitro-1H-pyrazol-1-yl)methyl]-1H-pyrazole
Compound characteristics
| Compound ID: | Y505-6872 |
| Compound Name: | 4-bromo-3,5-bis(4-methylphenyl)-1-[(4-nitro-1H-pyrazol-1-yl)methyl]-1H-pyrazole |
| Molecular Weight: | 452.31 |
| Molecular Formula: | C21 H18 Br N5 O2 |
| Smiles: | Cc1ccc(cc1)c1c(c(c2ccc(C)cc2)n(Cn2cc(cn2)[N+]([O-])=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.0823 |
| logD: | 5.0823 |
| logSw: | -4.8042 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.781 |
| InChI Key: | AGPUTQNTAOSKTA-UHFFFAOYSA-N |