N-({1-[(2-methylphenyl)methyl]piperidin-4-yl}methyl)-5-(6-oxo-1,6-dihydropyridazin-3-yl)thiophene-2-sulfonamide
Chemical Structure Depiction of
N-({1-[(2-methylphenyl)methyl]piperidin-4-yl}methyl)-5-(6-oxo-1,6-dihydropyridazin-3-yl)thiophene-2-sulfonamide
N-({1-[(2-methylphenyl)methyl]piperidin-4-yl}methyl)-5-(6-oxo-1,6-dihydropyridazin-3-yl)thiophene-2-sulfonamide
Compound characteristics
Compound ID: | G115-0608 |
Compound Name: | N-({1-[(2-methylphenyl)methyl]piperidin-4-yl}methyl)-5-(6-oxo-1,6-dihydropyridazin-3-yl)thiophene-2-sulfonamide |
Molecular Weight: | 458.6 |
Molecular Formula: | C22 H26 N4 O3 S2 |
Smiles: | Cc1ccccc1CN1CCC(CC1)CNS(c1ccc(C2C=CC(NN=2)=O)s1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.3568 |
logD: | 2.8092 |
logSw: | -4.147 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 83.885 |
InChI Key: | QRVAQEGQSXCHRD-UHFFFAOYSA-N |