1-(4-ethylphenyl)-2-hydroxy-2-(4-nitrophenyl)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium--bromide (1/1)

Chemical Structure Depiction of
1-(4-ethylphenyl)-2-hydroxy-2-(4-nitrophenyl)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium--bromide (1/1)
Available: 31 mg
Amount:
mg
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Compound characteristics

Compound ID: K843-0059
Compound Name: 1-(4-ethylphenyl)-2-hydroxy-2-(4-nitrophenyl)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium--bromide (1/1)
Molecular Weight: 460.37
Molecular Formula: C22 H26 N3 O3
Salt: Br-
Smiles: CCc1ccc(cc1)[N+]1=C2CCCCCN2CC1(c1ccc(cc1)[N+]([O-])=O)O
Stereo: RACEMIC MIXTURE
logP: 5.0472
logD: 5.0472
logSw: -4.3851
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 1
Polar surface area: 56.642
InChI Key: AWEMMHFHLYZBPG-QFIPXVFZSA-N
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