2-{[(3-fluorophenyl)methyl]sulfanyl}-6,6-dimethyl-9-(4-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one

Chemical Structure Depiction of
2-{[(3-fluorophenyl)methyl]sulfanyl}-6,6-dimethyl-9-(4-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Available: 123 mg
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mg
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Compound characteristics

Compound ID: C202-2987
Compound Name: 2-{[(3-fluorophenyl)methyl]sulfanyl}-6,6-dimethyl-9-(4-nitrophenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Molecular Weight: 479.53
Molecular Formula: C24 H22 F N5 O3 S
Smiles: CC1(C)CC2=C(C(c3ccc(cc3)[N+]([O-])=O)n3c(N2)nc(n3)SCc2cccc(c2)F)C(C1)=O
Stereo: RACEMIC MIXTURE
logP: 5.2733
logD: 5.1343
logSw: -5.276
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 82.448
InChI Key: SQVWGIYSZOFABV-NRFANRHFSA-N
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