5-[(4-bromoanilino)methyl]-2-({[4-(propan-2-yl)phenyl]methyl}amino)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one

Chemical Structure Depiction of
5-[(4-bromoanilino)methyl]-2-({[4-(propan-2-yl)phenyl]methyl}amino)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Available: 172 mg
Amount:
mg
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Compound characteristics

Compound ID: D412-0437
Compound Name: 5-[(4-bromoanilino)methyl]-2-({[4-(propan-2-yl)phenyl]methyl}amino)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Molecular Weight: 467.37
Molecular Formula: C22 H23 Br N6 O
Smiles: CC(C)c1ccc(CNc2nc3NC(CNc4ccc(cc4)[Br])=CC(n3n2)=O)cc1
Stereo: ACHIRAL
logP: 4.8596
logD: 4.5738
logSw: -4.5572
Hydrogen bond acceptors count: 4
Hydrogen bond donors count: 3
Polar surface area: 73.215
InChI Key: LYUYRJSXFQWONS-UHFFFAOYSA-N
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