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

Chemical Structure Depiction of
N-(2-{[(2-ethyl-7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)cyclohexanecarboxamide
Available: 53 mg
Amount:
mg
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Compound characteristics

Compound ID: G647-2965
Compound Name: N-(2-{[(2-ethyl-7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)cyclohexanecarboxamide
Molecular Weight: 468.6
Molecular Formula: C22 H24 N6 O2 S2
Smiles: CCC1NC2=NC(CSc3nc4ccc(cc4s3)NC(C3CCCCC3)=O)=CC(N2N=1)=O
Stereo: ACHIRAL
logP: 4.1202
logD: 4.1202
logSw: -4.1257
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 2
Polar surface area: 84.57
InChI Key: RYTQUVCSXLDGQH-UHFFFAOYSA-N
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