N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide

Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Available: 12 mg
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mg
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Compound characteristics

Compound ID: V030-1396
Compound Name: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-({[4-(2-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Molecular Weight: 551.62
Molecular Formula: C30 H25 N5 O4 S
Salt: not_available
Smiles: COc1ccccc1n1c(c2cccnc2)nnc1SCc1cccc(c1)C(NCc1ccc2c(c1)OCO2)=O
Stereo: ACHIRAL
logP: 4.1103
logD: 4.1061
logSw: -4.1671
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 83.089
InChI Key: YVYUKRUVJUUJFC-UHFFFAOYSA-N
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