Name: Name:2-methyl-5-[(2-methylpiperidin-1-yl)sulfonyl]benzoic acid
Brand: Angene
SKU: AG019JW4
Rating: 90 (10 reviews)

2-methyl-5-[(2-methylpiperidin-1-yl)sulfonyl]benzoic acid

CAS No.:

784171-98-8

Catalog Number:

AG019JW4

Molecular Formula:

C14H19NO4S

Molecular Weight:

297.3700

Catalog Number:

AG019JW4

Chemical Name:

2-methyl-5-[(2-methylpiperidin-1-yl)sulfonyl]benzoic acid

CAS Number:

784171-98-8

Molecular Formula:

C14H19NO4S

Molecular Weight:

297.3700

MDL Number:

MFCD06348995

IUPAC Name:

2-methyl-5-(2-methylpiperidin-1-yl)sulfonylbenzoic acid

InChI:

InChI=1S/C14H19NO4S/c1-10-6-7-12(9-13(10)14(16)17)20(18,19)15-8-4-3-5-11(15)2/h6-7,9,11H,3-5,8H2,1-2H3,(H,16,17)

InChI Key:

ODHGDCMMIGKPGS-UHFFFAOYSA-N

SMILES:

CC1CCCCN1S(=O)(=O)c1ccc(c(c1)C(=O)O)C

Complexity:

456

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

297.103g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

297.369g/mol

Monoisotopic Mass:

297.103g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2