methyl 3-amino-4-[(2-methylpropyl)sulfanyl]-6-nitro-1-benzothiophene-2-carboxylate

Chemical Structure Depiction of
methyl 3-amino-4-[(2-methylpropyl)sulfanyl]-6-nitro-1-benzothiophene-2-carboxylate
Available: 13 mg
Amount:
mg
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Compound characteristics

Compound ID: 8012-5610
Compound Name: methyl 3-amino-4-[(2-methylpropyl)sulfanyl]-6-nitro-1-benzothiophene-2-carboxylate
Molecular Weight: 340.42
Molecular Formula: C14 H16 N2 O4 S2
Smiles: CC(C)CSc1cc(cc2c1c(c(C(=O)OC)s2)N)[N+]([O-])=O
Stereo: ACHIRAL
logP: 4.1205
logD: 4.1205
logSw: -4.5336
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 2
Polar surface area: 74.927
InChI Key: POZSDOMOSSHYLS-UHFFFAOYSA-N
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