3-[4-(3-chlorophenyl)piperazine-1-sulfonyl]-N-cyclooctyl-1-methyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
3-[4-(3-chlorophenyl)piperazine-1-sulfonyl]-N-cyclooctyl-1-methyl-1H-pyrazole-4-carboxamide
3-[4-(3-chlorophenyl)piperazine-1-sulfonyl]-N-cyclooctyl-1-methyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-6185 |
| Compound Name: | 3-[4-(3-chlorophenyl)piperazine-1-sulfonyl]-N-cyclooctyl-1-methyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 494.06 |
| Molecular Formula: | C23 H32 Cl N5 O3 S |
| Smiles: | Cn1cc(C(NC2CCCCCCC2)=O)c(n1)S(N1CCN(CC1)c1cccc(c1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2445 |
| logD: | 4.2445 |
| logSw: | -4.5102 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.81 |
| InChI Key: | ROMVCDIEPHKVJD-UHFFFAOYSA-N |