Name: Name:2-{[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]sulfanyl}acetic acid
Brand: Angene
SKU: AG01A4NI
Rating: 90 (10 reviews)

2-{[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]sulfanyl}acetic acid

CAS No.:

1310235-89-2

Catalog Number:

AG01A4NI

Molecular Formula:

C9H7N3O3S

Molecular Weight:

237.2352

Catalog Number:

AG01A4NI

Chemical Name:

2-{[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]sulfanyl}acetic acid

CAS Number:

1310235-89-2

Molecular Formula:

C9H7N3O3S

Molecular Weight:

237.2352

MDL Number:

MFCD17259873

IUPAC Name:

2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)sulfanyl]acetic acid

InChI:

InChI=1S/C9H7N3O3S/c13-7(14)5-16-9-11-8(12-15-9)6-2-1-3-10-4-6/h1-4H,5H2,(H,13,14)

InChI Key:

QRZFAZFERDAIDL-UHFFFAOYSA-N

SMILES:

OC(=O)CSc1onc(n1)c1cccnc1

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

237.021g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

237.233g/mol

Monoisotopic Mass:

237.021g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

114A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2