N-{2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N,3,3-trimethylbutanamide
Chemical Structure Depiction of
N-{2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N,3,3-trimethylbutanamide
N-{2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N,3,3-trimethylbutanamide
Compound characteristics
| Compound ID: | V031-0878 |
| Compound Name: | N-{2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N,3,3-trimethylbutanamide |
| Molecular Weight: | 415.53 |
| Molecular Formula: | C22 H26 F N3 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N(C)CC(N1C(CC(c2cccs2)=N1)c1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5615 |
| logD: | 4.5615 |
| logSw: | -4.4185 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.772 |
| InChI Key: | MXXAMJRZBMNROP-GOSISDBHSA-N |