Name: Name:1-methyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxylic acid
Brand: Angene
SKU: AG019MJT
Rating: 90 (10 reviews)

1-methyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxylic acid

CAS No.:

937625-15-5

Catalog Number:

AG019MJT

Molecular Formula:

C11H16N2O4S

Molecular Weight:

272.3207

Catalog Number:

AG019MJT

Chemical Name:

1-methyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxylic acid

CAS Number:

937625-15-5

Molecular Formula:

C11H16N2O4S

Molecular Weight:

272.3207

MDL Number:

MFCD09052822

IUPAC Name:

1-methyl-4-piperidin-1-ylsulfonylpyrrole-2-carboxylic acid

InChI:

InChI=1S/C11H16N2O4S/c1-12-8-9(7-10(12)11(14)15)18(16,17)13-5-3-2-4-6-13/h7-8H,2-6H2,1H3,(H,14,15)

InChI Key:

KSRZOKMBEVEESD-UHFFFAOYSA-N

SMILES:

OC(=O)c1cc(cn1C)S(=O)(=O)N1CCCCC1

Complexity:

411

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

272.083g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

272.319g/mol

Monoisotopic Mass:

272.083g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

88A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5