Name: Name:6-(4-methyl-3-oxopiperazin-1-yl)pyridine-2-carboxylic acid
Brand: Angene
SKU: AG01B27Q
Rating: 90 (10 reviews)

6-(4-methyl-3-oxopiperazin-1-yl)pyridine-2-carboxylic acid

CAS No.:

1378724-53-8

Catalog Number:

AG01B27Q

Molecular Formula:

C11H13N3O3

Molecular Weight:

235.2392

Catalog Number:

AG01B27Q

Chemical Name:

6-(4-methyl-3-oxopiperazin-1-yl)pyridine-2-carboxylic acid

CAS Number:

1378724-53-8

Molecular Formula:

C11H13N3O3

Molecular Weight:

235.2392

MDL Number:

MFCD20596189

IUPAC Name:

6-(4-methyl-3-oxopiperazin-1-yl)pyridine-2-carboxylic acid

InChI:

InChI=1S/C11H13N3O3/c1-13-5-6-14(7-10(13)15)9-4-2-3-8(12-9)11(16)17/h2-4H,5-7H2,1H3,(H,16,17)

InChI Key:

FULCUBMRLWQRSA-UHFFFAOYSA-N

SMILES:

O=C1CN(CCN1C)c1cccc(n1)C(=O)O

Complexity:

321

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

235.096g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

235.243g/mol

Monoisotopic Mass:

235.096g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

73.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5