N-[(2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)carbamothioyl]amino}-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide

Chemical Structure Depiction of
N-[(2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)carbamothioyl]amino}-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
Available: 155 mg
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mg
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Compound characteristics

Compound ID: K786-0268
Compound Name: N-[(2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)carbamothioyl]amino}-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
Molecular Weight: 593.75
Molecular Formula: C34 H35 N5 O3 S
Smiles: Cc1ccc(cc1)NC(Nc1cc(ccc1N1CC2CC(C1)C1=CC=CC(N1C2)=O)C(NCc1ccccc1OC)=O)=S
Stereo: MIXTURE OF STEREOISOMERS
logP: 6.3752
logD: 6.3751
logSw: -5.5374
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 3
Polar surface area: 69.257
InChI Key: YHUKRLOUNZVMCI-UHFFFAOYSA-N
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