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3-Amino-3-[5-(4-bromophenyl)furan-2-yl]propanamide

HCID 53471783
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Basic information

CAS
771522-77-1
Standard SMILES
NC(=O)CC(N)c1ccc(-c2ccc(Br)cc2)o1
InChIKey
HGHNADQEUHLCGS-UHFFFAOYSA-N
Molecular formula
C13H13BrN2O2
Average molar mass
309.16 g/mol
Monoisotopic mass
308.01604

Names & identifiers

Preferred name
3-Amino-3-[5-(4-bromophenyl)furan-2-yl]propanamide
IUPAC
3-amino-3-[5-(4-bromophenyl)furan-2-yl]propanamide
English name
3-Amino-3-[5-(4-bromophenyl)-furan-2-yl]-propionic acid amide
Molecular formula
C13H13BrN2O2
Molecular weight
309.16

Names & synonyms

771522-77-13-amino-3-[5-(4-bromophenyl)furan-2-yl]propanamide3-Amino-3-(5-(4-bromophenyl)furan-2-yl)propanamideDTXSID00703746RARECHEM AL BZ 07792-Furanpropanamide, β-amino-5-(4-bromophenyl)-3-Amino-3-[5-(4-bromophenyl)-furan-2-yl]-propionic acid amide

Database identifiers

CAS
771522-77-1
PubChem CID
53471783
DTXSID
DTXSID00703746

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
82.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Formal charge
0
Complexity
293

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