Name: Name:5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2-carboxylic acid
Brand: Angene
SKU: AG00J54R
Rating: 90 (10 reviews)

5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2-carboxylic acid

CAS No.:

1171337-80-6

Catalog Number:

AG00J54R

Molecular Formula:

C11H15NO4S2

Molecular Weight:

289.3711

Catalog Number:

AG00J54R

Chemical Name:

5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2-carboxylic acid

CAS Number:

1171337-80-6

Molecular Formula:

C11H15NO4S2

Molecular Weight:

289.3711

MDL Number:

MFCD12857511

IUPAC Name:

5-(4-methylpiperidin-1-yl)sulfonylthiophene-2-carboxylic acid

InChI:

InChI=1S/C11H15NO4S2/c1-8-4-6-12(7-5-8)18(15,16)10-3-2-9(17-10)11(13)14/h2-3,8H,4-7H2,1H3,(H,13,14)

InChI Key:

LJLXIBYAFITSNA-UHFFFAOYSA-N

SMILES:

CC1CCN(CC1)S(=O)(=O)c1ccc(s1)C(=O)O

Complexity:

409

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

289.044g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

289.364g/mol

Monoisotopic Mass:

289.044g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

111A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2