N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
Chemical Structure Depiction of
N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
Compound characteristics
Compound ID: | G718-0908 |
Compound Name: | N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide |
Molecular Weight: | 410.54 |
Molecular Formula: | C22 H26 N4 O2 S |
Smiles: | Cc1ccc(Cc2nc(CCNS(c3ccc4CCCCc4c3)(=O)=O)n[nH]2)cc1 |
Stereo: | ACHIRAL |
logP: | 4.8161 |
logD: | 4.8147 |
logSw: | -4.597 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.525 |
InChI Key: | PCTFCPMFXFPHIJ-UHFFFAOYSA-N |