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1186113-76-7

1186113-76-7 | 4-carbaMoyl-6-(3-ethylureido)pyridin-3-ylboronic acid

CAS No: 1186113-76-7 Catalog No: AG0099M6 MDL No:

Product Description

Catalog Number:
AG0099M6
Chemical Name:
4-carbaMoyl-6-(3-ethylureido)pyridin-3-ylboronic acid
CAS Number:
1186113-76-7
IUPAC Name:
[4-carbamoyl-6-(ethylcarbamoylamino)pyridin-3-yl]boronic acid
InChI:
InChI=1S/C9H13BN4O4/c1-2-12-9(16)14-7-3-5(8(11)15)6(4-13-7)10(17)18/h3-4,17-18H,2H2,1H3,(H2,11,15)(H2,12,13,14,16)
InChI Key:
WRBAZVFYOVRWLT-UHFFFAOYSA-N

Properties

Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.103g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
252.037g/mol
Monoisotopic Mass:
252.103g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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