5-(4-methoxyphenyl)-8,8-dimethyl-2-{[(3-nitrophenyl)methyl]sulfanyl}-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione

Chemical Structure Depiction of
5-(4-methoxyphenyl)-8,8-dimethyl-2-{[(3-nitrophenyl)methyl]sulfanyl}-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Available: 171 mg
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mg
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Compound characteristics

Compound ID: C202-0842
Compound Name: 5-(4-methoxyphenyl)-8,8-dimethyl-2-{[(3-nitrophenyl)methyl]sulfanyl}-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Molecular Weight: 518.59
Molecular Formula: C27 H26 N4 O5 S
Smiles: CC1(C)CC2=C(C(C3=C(N2)N=C(NC3=O)SCc2cccc(c2)[N+]([O-])=O)c2ccc(cc2)OC)C(C1)=O
Stereo: RACEMIC MIXTURE
logP: 4.0119
logD: 2.192
logSw: -4.3708
Hydrogen bond acceptors count: 11
Hydrogen bond donors count: 2
Polar surface area: 98.276
InChI Key: FFWHPRQGTBZSDE-OAQYLSRUSA-N
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