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

Chemical Structure Depiction of
5-[4-(diethylamino)phenyl]-2-{[(4-nitrophenyl)methyl]sulfanyl}-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Available: 193 mg
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mg
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Compound characteristics

Compound ID: C117-0083
Compound Name: 5-[4-(diethylamino)phenyl]-2-{[(4-nitrophenyl)methyl]sulfanyl}-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Molecular Weight: 531.63
Molecular Formula: C28 H29 N5 O4 S
Smiles: CCN(CC)c1ccc(cc1)C1C2=C(CCCC2=O)NC2=C1C(NC(=N2)SCc1ccc(cc1)[N+]([O-])=O)=O
Stereo: RACEMIC MIXTURE
logP: 4.0204
logD: 2.5824
logSw: -4.1095
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 2
Polar surface area: 93.468
InChI Key: URABBKMTLPXYCO-HSZRJFAPSA-N
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