N,3,3-trimethyl-N-{2-oxo-2-[5-phenyl-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethyl}butanamide
Chemical Structure Depiction of
N,3,3-trimethyl-N-{2-oxo-2-[5-phenyl-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethyl}butanamide
N,3,3-trimethyl-N-{2-oxo-2-[5-phenyl-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethyl}butanamide
Compound characteristics
| Compound ID: | V031-2202 |
| Compound Name: | N,3,3-trimethyl-N-{2-oxo-2-[5-phenyl-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethyl}butanamide |
| Molecular Weight: | 397.54 |
| Molecular Formula: | C22 H27 N3 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N(C)CC(N1C(CC(c2cccs2)=N1)c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5367 |
| logD: | 4.5367 |
| logSw: | -4.3102 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.772 |
| InChI Key: | ITBRQFREUJWMGD-GOSISDBHSA-N |