1-{4-[4-(2-fluorophenyl)piperazin-1-yl]-4-oxobutyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide
Chemical Structure Depiction of
1-{4-[4-(2-fluorophenyl)piperazin-1-yl]-4-oxobutyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide
1-{4-[4-(2-fluorophenyl)piperazin-1-yl]-4-oxobutyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide
Compound characteristics
| Compound ID: | F848-0447 |
| Compound Name: | 1-{4-[4-(2-fluorophenyl)piperazin-1-yl]-4-oxobutyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide |
| Molecular Weight: | 474.56 |
| Molecular Formula: | C22 H27 F N6 O3 S |
| Smiles: | CN(C)S(c1ccc2c(c1)nnn2CCCC(N1CCN(CC1)c1ccccc1F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.682 |
| logD: | 1.682 |
| logSw: | -2.5304 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.658 |
| InChI Key: | RJPWERHJVUAXOH-UHFFFAOYSA-N |