{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methanone
Chemical Structure Depiction of
{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methanone
{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methanone
Compound characteristics
| Compound ID: | 8017-4890 |
| Compound Name: | {4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methanone |
| Molecular Weight: | 502.59 |
| Molecular Formula: | C26 H26 N6 O3 S |
| Smiles: | Cc1cc(C)n(c2cc(ccc2[N+]([O-])=O)N2CCN(CC2)C(c2ccc(cc2)c2csc(C)n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.887 |
| logD: | 3.887 |
| logSw: | -3.9574 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.339 |
| InChI Key: | KALHNFJVFWZMKW-UHFFFAOYSA-N |