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Oprea1_730177,ZINC00904174,ASN 03929729,[6-Chloro-2-(4-chloro-phenyl)-

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摘 要:Oprea1_730177,ZINC00904174,ASN 03929729,[6-Chloro-2-(4-chloro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-cyclohexyl-amine, 6-chloro-2-(4-chlorophenyl)-N-cyclohexylimidazo[3,2-a]pyridin-3-amine,Canonical SMILES: C1CCC(CC1)NC2=C(N=C3N2C=C(C=C3)Cl)C4=CC=C(C=C4
[Synonyms]
Oprea1_730177
ZINC00904174
ASN 03929729
[6-Chloro-2-(4-chloro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-cyclohexyl-amine

[Structure]
Oprea1_730177,ZINC00904174,ASN 03929729,[6-Chloro-2-(4-chloro-phenyl)-

[ Properties Computed from Structure]
Molecular Weight360.28026 [g/mol]
Molecular FormulaC19H19Cl2N3
XLogP4.1
H-Bond Donor1
H-Bond Acceptor3
Rotatable Bond Count3
Exact Mass359.095603
MonoIsotopic Mass359.095603
Topological Polar Surface Area29.3
Heavy Atom Count24
Formal Charge0
Complexity407
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 6-chloro-2-(4-chlorophenyl)-N-cyclohexylimidazo[3,2-a]pyridin-3-amine
Canonical SMILES: C1CCC(CC1)NC2=C(N=C3N2C=C(C=C3)Cl)C4=CC=C(C=C4)Cl
InChI: InChI=1/C19H19Cl2N3/c20-14-8-6-13(7-9-14)18-19(22-16-4-2-1-3-5-16)24-12-
15(21)10-11-17(24)23-18/h6-12,16,22H,1-5H2

 
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