N-(3-methylphenyl)-3-(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)butanamide

Chemical Structure Depiction of
N-(3-methylphenyl)-3-(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)butanamide
Available: 50 mg
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mg
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Compound characteristics

Compound ID: L705-0613
Compound Name: N-(3-methylphenyl)-3-(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)butanamide
Molecular Weight: 418.53
Molecular Formula: C20 H22 N2 O4 S2
Smiles: CC(CC(Nc1cccc(C)c1)=O)S(c1ccc2c(c1)NC(CCS2)=O)(=O)=O
Stereo: RACEMIC MIXTURE
logP: 2.6622
logD: 2.6621
logSw: -3.096
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 2
Polar surface area: 78.04
InChI Key: QNUAYQHJAIDDFS-AWEZNQCLSA-N
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