Name: Name:2-(3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetic acid
Brand: Angene
SKU: AG019MSA
Rating: 90 (10 reviews)

2-(3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetic acid

CAS No.:

1087792-24-2

Catalog Number:

AG019MSA

Molecular Formula:

C10H11NO2S

Molecular Weight:

209.2648

Catalog Number:

AG019MSA

Chemical Name:

2-(3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetic acid

CAS Number:

1087792-24-2

Molecular Formula:

C10H11NO2S

Molecular Weight:

209.2648

MDL Number:

MFCD11099497

IUPAC Name:

2-(3,4-dihydro-2H-1,4-benzothiazin-2-yl)acetic acid

InChI:

InChI=1S/C10H11NO2S/c12-10(13)5-7-6-11-8-3-1-2-4-9(8)14-7/h1-4,7,11H,5-6H2,(H,12,13)

InChI Key:

WHXREQRBHITPQZ-UHFFFAOYSA-N

SMILES:

OC(=O)CC1CNc2c(S1)cccc2

Complexity:

222

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

209.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

209.263g/mol

Monoisotopic Mass:

209.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8