N-[(furan-2-yl)methyl]-4-({[4-(3-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-4-({[4-(3-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-[(furan-2-yl)methyl]-4-({[4-(3-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
Compound ID: | V024-7977 |
Compound Name: | N-[(furan-2-yl)methyl]-4-({[4-(3-methylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
Molecular Weight: | 486.61 |
Molecular Formula: | C26 H22 N4 O2 S2 |
Salt: | not_available |
Smiles: | Cc1cccc(c1)n1c(c2cccs2)nnc1SCc1ccc(cc1)C(NCc1ccco1)=O |
Stereo: | ACHIRAL |
logP: | 5.5477 |
logD: | 5.5474 |
logSw: | -5.3619 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.893 |
InChI Key: | NJSJGGJUZYGLRS-UHFFFAOYSA-N |