N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)cyclohexanecarboxamide

Chemical Structure Depiction of
N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)cyclohexanecarboxamide
Available: 114 mg
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mg
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Compound characteristics

Compound ID: G072-1841
Compound Name: N-(2-{[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)cyclohexanecarboxamide
Molecular Weight: 471.62
Molecular Formula: C21 H21 N5 O2 S3
Smiles: CC1=NN2C(=NC(CSc3nc4ccc(cc4s3)NC(C3CCCCC3)=O)=CC2=O)S1
Stereo: ACHIRAL
logP: 4.6526
logD: 4.6501
logSw: -4.4177
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 69.809
InChI Key: KQOCNFUXHSVIIO-UHFFFAOYSA-N
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