2-amino-4-(5-nitrothiophen-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile

Chemical Structure Depiction of
2-amino-4-(5-nitrothiophen-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Available: 73 mg
Amount:
mg
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Compound characteristics

Compound ID: 4333-4442
Compound Name: 2-amino-4-(5-nitrothiophen-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Molecular Weight: 317.32
Molecular Formula: C14 H11 N3 O4 S
Smiles: C1CC2=C(C(C(C#N)=C(N)O2)c2ccc([N+]([O-])=O)s2)C(C1)=O
Stereo: RACEMIC MIXTURE
logP: 1.7412
logD: 1.7412
logSw: -2.26
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 2
Polar surface area: 94.354
InChI Key: IPJWTSJMWTZDFW-LBPRGKRZSA-N
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