N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-[4-(thiophene-2-sulfonyl)piperazin-1-yl]acetamide
Chemical Structure Depiction of
N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-[4-(thiophene-2-sulfonyl)piperazin-1-yl]acetamide
N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-[4-(thiophene-2-sulfonyl)piperazin-1-yl]acetamide
Compound characteristics
| Compound ID: | Y503-1260 |
| Compound Name: | N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-[4-(thiophene-2-sulfonyl)piperazin-1-yl]acetamide |
| Molecular Weight: | 498 |
| Molecular Formula: | C20 H21 Cl F N5 O3 S2 |
| Smiles: | C1CN(CCN1CC(Nc1ccn(Cc2c(cccc2[Cl])F)n1)=O)S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8692 |
| logD: | 2.868 |
| logSw: | -3.419 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.613 |
| InChI Key: | TXBXCRNZQINMMY-UHFFFAOYSA-N |