N-{3-methyl-1-oxo-1-[4-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]butan-2-yl}benzenesulfonamide
Chemical Structure Depiction of
N-{3-methyl-1-oxo-1-[4-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]butan-2-yl}benzenesulfonamide
N-{3-methyl-1-oxo-1-[4-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]butan-2-yl}benzenesulfonamide
Compound characteristics
| Compound ID: | F897-0616 |
| Compound Name: | N-{3-methyl-1-oxo-1-[4-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]butan-2-yl}benzenesulfonamide |
| Molecular Weight: | 497.63 |
| Molecular Formula: | C21 H31 N5 O5 S2 |
| Smiles: | CC(C)C(C(N1CCN(CC1)S(c1c(C)nn(C)c1C)(=O)=O)=O)NS(c1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6741 |
| logD: | 0.6738 |
| logSw: | -2.428 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.84 |
| InChI Key: | KZPGYBVIOIRLRY-IBGZPJMESA-N |