Name: Name:6-[(1,3-benzothiazol-2-yl)amino]hexanoic acid
Brand: Angene
SKU: AG019OQP
Rating: 90 (10 reviews)

6-[(1,3-benzothiazol-2-yl)amino]hexanoic acid

CAS No.:

871548-18-4

Catalog Number:

AG019OQP

Molecular Formula:

C13H16N2O2S

Molecular Weight:

264.3433

Catalog Number:

AG019OQP

Chemical Name:

6-[(1,3-benzothiazol-2-yl)amino]hexanoic acid

CAS Number:

871548-18-4

Molecular Formula:

C13H16N2O2S

Molecular Weight:

264.3433

MDL Number:

MFCD07352234

IUPAC Name:

6-(1,3-benzothiazol-2-ylamino)hexanoic acid

InChI:

InChI=1S/C13H16N2O2S/c16-12(17)8-2-1-5-9-14-13-15-10-6-3-4-7-11(10)18-13/h3-4,6-7H,1-2,5,8-9H2,(H,14,15)(H,16,17)

InChI Key:

BRMMFCVJUTXQIG-UHFFFAOYSA-N

SMILES:

OC(=O)CCCCCNc1nc2c(s1)cccc2

Complexity:

276

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

264.093g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

264.343g/mol

Monoisotopic Mass:

264.093g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

90.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3