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82952-65-6

82952-65-6 | 2-((3,5-DIBROMO-2,6-DIMETHOXYBENZAMIDO)METHYL)-1-ETHYLPYRROLIDINE HYDR OCHLORIDE

CAS No: 82952-65-6 Catalog No: AG005492 MDL No:

Product Description

Catalog Number:
AG005492
Chemical Name:
2-((3,5-DIBROMO-2,6-DIMETHOXYBENZAMIDO)METHYL)-1-ETHYLPYRROLIDINE HYDR OCHLORIDE
CAS Number:
82952-65-6
Molecular Formula:
C16H23Br2ClN2O3
Molecular Weight:
486.6264
IUPAC Name:
3,5-dibromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,6-dimethoxybenzamide;hydrochloride
InChI:
InChI=1S/C16H22Br2N2O3.ClH/c1-4-20-7-5-6-10(20)9-19-16(21)13-14(22-2)11(17)8-12(18)15(13)23-3;/h8,10H,4-7,9H2,1-3H3,(H,19,21);1H
InChI Key:
HRXLYQNSAFLNEJ-UHFFFAOYSA-N
SMILES:
CCN1CCCC1CNC(=O)c1c(OC)c(Br)cc(c1OC)Br.Cl

Properties

Complexity:
384  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
485.974g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
486.629g/mol
Monoisotopic Mass:
483.976g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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