N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzene-1-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V026-9832 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)benzene-1-sulfonamide |
| Molecular Weight: | 599.71 |
| Molecular Formula: | C32 H33 N5 O5 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1ccc(nn1)N1CCN(CC1)C(CN(Cc1ccc2c(c1)OCO2)S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1611 |
| logD: | 5.1404 |
| logSw: | -5.0486 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.046 |
| InChI Key: | VKJLOGAEPVRAAC-UHFFFAOYSA-N |