ethyl [4-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1H-1,5-benzodiazepin-2-yl]acetate

Chemical Structure Depiction of
ethyl [4-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1H-1,5-benzodiazepin-2-yl]acetate
Available: 45 mg
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mg
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Compound characteristics

Compound ID: F405-0354
Compound Name: ethyl [4-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1H-1,5-benzodiazepin-2-yl]acetate
Molecular Weight: 420.45
Molecular Formula: C21 H19 F3 N2 O2 S
Smiles: CCOC(CC1=CC(=Nc2ccccc2N1)SCc1cccc(c1)C(F)(F)F)=O
Stereo: ACHIRAL
logP: 5.1364
logD: 5.1363
logSw: -5.0546
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 1
Polar surface area: 41.334
InChI Key: IPRFRZDQPWQYLD-UHFFFAOYSA-N
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