Home Aminos 2-amino-3-{1H-pyrrolo[3,2-b]pyridin-3-yl}propanoic acid dihydrochloride

2-amino-3-{1H-pyrrolo[3,2-b]pyridin-3-yl}propanoic acid dihydrochloride

CAS No.:
1803560-72-6
Catalog Number:
AG01B85U
Molecular Formula:
C10H13Cl2N3O2
Molecular Weight:
278.1351
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Product Description
Catalog Number:
AG01B85U
Chemical Name:
2-amino-3-{1H-pyrrolo[3,2-b]pyridin-3-yl}propanoic acid dihydrochloride
CAS Number:
1803560-72-6
Molecular Formula:
C10H13Cl2N3O2
Molecular Weight:
278.1351
MDL Number:
MFCD28246399
IUPAC Name:
2-amino-3-(1H-pyrrolo[3,2-b]pyridin-3-yl)propanoic acid;dihydrochloride
InChI:
InChI=1S/C10H11N3O2.2ClH/c11-7(10(14)15)4-6-5-13-8-2-1-3-12-9(6)8;;/h1-3,5,7,13H,4,11H2,(H,14,15);2*1H
InChI Key:
JTXFLRYKLXMHHQ-UHFFFAOYSA-N
SMILES:
OC(=O)C(Cc1c[nH]c2c1nccc2)N.Cl.Cl
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.038g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
278.133g/mol
Monoisotopic Mass:
277.038g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties