Name: Name:2-bromo-6H-pyrrolo[3,2-d]thiazole-5-carboxylic acid
Brand: Angene
SKU: AG00H2G1
Rating: 90 (10 reviews)

2-bromo-6H-pyrrolo[3,2-d]thiazole-5-carboxylic acid

CAS No.:

881888-42-2

Catalog Number:

AG00H2G1

Molecular Formula:

C6H3BrN2O2S

Molecular Weight:

247.0692

Catalog Number:

AG00H2G1

Chemical Name:

2-bromo-6H-pyrrolo[3,2-d]thiazole-5-carboxylic acid

CAS Number:

881888-42-2

Molecular Formula:

C6H3BrN2O2S

Molecular Weight:

247.0692

MDL Number:

MFCD19687488

IUPAC Name:

2-bromo-4H-pyrrolo[3,2-d][1,3]thiazole-5-carboxylic acid

InChI:

InChI=1S/C6H3BrN2O2S/c7-6-9-2-1-3(5(10)11)8-4(2)12-6/h1,8H,(H,10,11)

InChI Key:

SVIVRHLPLTZAAE-UHFFFAOYSA-N

SMILES:

Brc1nc2c(s1)[nH]c(c2)C(=O)O

Complexity:

216

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

245.91g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.066g/mol

Monoisotopic Mass:

245.91g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

94.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4