Name: Name:Benzothiazole, 2-(1H-pyrazol-3-yl)- (9CI)
Brand: Angene
SKU: AG003O2R
Rating: 90 (10 reviews)

Benzothiazole, 2-(1H-pyrazol-3-yl)- (9CI)

CAS No.:

256414-72-9

Catalog Number:

AG003O2R

Molecular Formula:

C10H7N3S

Molecular Weight:

201.2477

Catalog Number:

AG003O2R

Chemical Name:

Benzothiazole, 2-(1H-pyrazol-3-yl)- (9CI)

CAS Number:

256414-72-9

Molecular Formula:

C10H7N3S

Molecular Weight:

201.2477

MDL Number:

MFCD01934517

IUPAC Name:

2-(1H-pyrazol-5-yl)-1,3-benzothiazole

InChI:

InChI=1S/C10H7N3S/c1-2-4-9-7(3-1)12-10(14-9)8-5-6-11-13-8/h1-6H,(H,11,13)

InChI Key:

YAMYGQRUEXYQIE-UHFFFAOYSA-N

SMILES:

n1ccc([nH]1)c1nc2c(s1)cccc2

Complexity:

212

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

201.036g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

201.247g/mol

Monoisotopic Mass:

201.036g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4