Name: Name:5-(diethylsulfamoyl)-2-(pyrrolidin-1-yl)benzoic acid
Brand: Angene
SKU: AG019I9M
Rating: 90 (10 reviews)

5-(diethylsulfamoyl)-2-(pyrrolidin-1-yl)benzoic acid

CAS No.:

554425-46-6

Catalog Number:

AG019I9M

Molecular Formula:

C15H22N2O4S

Molecular Weight:

326.4112

Catalog Number:

AG019I9M

Chemical Name:

5-(diethylsulfamoyl)-2-(pyrrolidin-1-yl)benzoic acid

CAS Number:

554425-46-6

Molecular Formula:

C15H22N2O4S

Molecular Weight:

326.4112

MDL Number:

MFCD03985180

IUPAC Name:

5-(diethylsulfamoyl)-2-pyrrolidin-1-ylbenzoic acid

InChI:

InChI=1S/C15H22N2O4S/c1-3-17(4-2)22(20,21)12-7-8-14(13(11-12)15(18)19)16-9-5-6-10-16/h7-8,11H,3-6,9-10H2,1-2H3,(H,18,19)

InChI Key:

HNBOWLIJCWGZLP-UHFFFAOYSA-N

SMILES:

CCN(S(=O)(=O)c1ccc(c(c1)C(=O)O)N1CCCC1)CC

Complexity:

478

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

326.13g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

326.411g/mol

Monoisotopic Mass:

326.13g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9