6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine

Chemical Structure Depiction of
6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine
Available: 144 mg
Amount:
mg
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Compound characteristics

Compound ID: K784-6147
Compound Name: 6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-a]pyrimidine
Molecular Weight: 433.53
Molecular Formula: C23 H23 N5 O2 S
Smiles: Cc1ccc(C)c(Cc2c(C)nc3nc(nn3c2C)SCc2ccc(cc2)[N+]([O-])=O)c1
Stereo: ACHIRAL
logP: 5.4668
logD: 5.4666
logSw: -5.4296
Hydrogen bond acceptors count: 8
Polar surface area: 62.936
InChI Key: IWOWKBGDSDNDOC-UHFFFAOYSA-N
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