Name: Name:2-[(1,1-dioxo-1lambda6,2-benzothiazol-3-yl)amino]propanoic acid
Brand: Angene
SKU: AG019JAA
Rating: 90 (10 reviews)

2-[(1,1-dioxo-1lambda6,2-benzothiazol-3-yl)amino]propanoic acid

CAS No.:

1396994-80-1

Catalog Number:

AG019JAA

Molecular Formula:

C10H10N2O4S

Molecular Weight:

254.2624

Catalog Number:

AG019JAA

Chemical Name:

2-[(1,1-dioxo-1lambda6,2-benzothiazol-3-yl)amino]propanoic acid

CAS Number:

1396994-80-1

Molecular Formula:

C10H10N2O4S

Molecular Weight:

254.2624

MDL Number:

MFCD05262045

IUPAC Name:

2-[(1,1-dioxo-1,2-benzothiazol-3-ylidene)amino]propanoic acid

InChI:

InChI=1S/C10H10N2O4S/c1-6(10(13)14)11-9-7-4-2-3-5-8(7)17(15,16)12-9/h2-6H,1H3,(H,11,12)(H,13,14)

InChI Key:

FXIGPASFALLPHG-UHFFFAOYSA-N

SMILES:

OC(=O)C(NC1=NS(=O)(=O)c2c1cccc2)C

Complexity:

451

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.036g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.26g/mol

Monoisotopic Mass:

254.036g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

104A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2