3,6-diamino-4-butyl-2-(4-nitrobenzoyl)thieno[2,3-b]pyridine-5-carbonitrile

Chemical Structure Depiction of
3,6-diamino-4-butyl-2-(4-nitrobenzoyl)thieno[2,3-b]pyridine-5-carbonitrile
Available: 35 mg
Amount:
mg
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Compound characteristics

Compound ID: 3012-0024
Compound Name: 3,6-diamino-4-butyl-2-(4-nitrobenzoyl)thieno[2,3-b]pyridine-5-carbonitrile
Molecular Weight: 395.44
Molecular Formula: C19 H17 N5 O3 S
Smiles: CCCCc1c(C#N)c(N)nc2c1c(c(C(c1ccc(cc1)[N+]([O-])=O)=O)s2)N
Stereo: ACHIRAL
logP: 4.4439
logD: 4.4439
logSw: -4.8211
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 4
Polar surface area: 113.947
InChI Key: NXVRQFRILARXBE-UHFFFAOYSA-N
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