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1021342-97-1

1021342-97-1 | 1H-Indole-1-carboxylic acid, 2-borono-5-(1-piperidinylcarbonyl)-, 1-(1,1-dimethylethyl) ester

CAS No: 1021342-97-1 Catalog No: AG009PS3 MDL No:

Product Description

Catalog Number:
AG009PS3
Chemical Name:
1H-Indole-1-carboxylic acid, 2-borono-5-(1-piperidinylcarbonyl)-, 1-(1,1-dimethylethyl) ester
CAS Number:
1021342-97-1
IUPAC Name:
[1-[(2-methylpropan-2-yl)oxycarbonyl]-5-(piperidine-1-carbonyl)indol-2-yl]boronic acid
InChI:
InChI=1S/C19H25BN2O5/c1-19(2,3)27-18(24)22-15-8-7-13(11-14(15)12-16(22)20(25)26)17(23)21-9-5-4-6-10-21/h7-8,11-12,25-26H,4-6,9-10H2,1-3H3
InChI Key:
SGVLBCSJEPDDRZ-UHFFFAOYSA-N

Properties

Complexity:
559  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.186g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
372.228g/mol
Monoisotopic Mass:
372.186g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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