9-(4-bromophenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one

Chemical Structure Depiction of
9-(4-bromophenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Available: 120 mg
Amount:
mg
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Compound characteristics

Compound ID: C202-1436
Compound Name: 9-(4-bromophenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Molecular Weight: 512.38
Molecular Formula: C22 H18 Br N5 O3 S
Smiles: C1CC2=C(C(c3ccc(cc3)[Br])n3c(N2)nc(n3)SCc2ccc(cc2)[N+]([O-])=O)C(C1)=O
Stereo: RACEMIC MIXTURE
logP: 5.102
logD: 5.0401
logSw: -5.2594
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 82.448
InChI Key: DZMDHSFGYFQABZ-FQEVSTJZSA-N
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