3-methyl-N-[2-({[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methyl}sulfanyl)phenyl]benzamide

Chemical Structure Depiction of
3-methyl-N-[2-({[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methyl}sulfanyl)phenyl]benzamide
Available: 120 mg
Amount:
mg
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Compound characteristics

Compound ID: D439-6135
Compound Name: 3-methyl-N-[2-({[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methyl}sulfanyl)phenyl]benzamide
Molecular Weight: 433.53
Molecular Formula: C23 H23 N5 O2 S
Smiles: CC(C)N1C=NC2=NC(CSc3ccccc3NC(c3cccc(C)c3)=O)=CC(N12)=O
Stereo: ACHIRAL
logP: 2.9612
logD: 2.792
logSw: -3.4044
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 1
Polar surface area: 64.57
InChI Key: HQRQLHARSCXEKD-UHFFFAOYSA-N
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