N-{1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl}-2,1,3-benzothiadiazole-4-sulfonamide
Chemical Structure Depiction of
N-{1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl}-2,1,3-benzothiadiazole-4-sulfonamide
N-{1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl}-2,1,3-benzothiadiazole-4-sulfonamide
Compound characteristics
| Compound ID: | C548-2842 |
| Compound Name: | N-{1-[4-(3-chlorophenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl}-2,1,3-benzothiadiazole-4-sulfonamide |
| Molecular Weight: | 494.03 |
| Molecular Formula: | C21 H24 Cl N5 O3 S2 |
| Smiles: | CC(C)C(C(N1CCN(CC1)c1cccc(c1)[Cl])=O)NS(c1cccc2c1nsn2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5337 |
| logD: | 3.5101 |
| logSw: | -3.795 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.695 |
| InChI Key: | KFDPVXOAPDDKRN-IBGZPJMESA-N |