Name: Name:5-bromo-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]aniline
Brand: Angene
SKU: AG01A8R8
Rating: 90 (10 reviews)

5-bromo-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]aniline

CAS No.:

1019441-45-2

Catalog Number:

AG01A8R8

Molecular Formula:

C9H9BrN4S

Molecular Weight:

285.1636

Catalog Number:

AG01A8R8

Chemical Name:

5-bromo-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]aniline

CAS Number:

1019441-45-2

Molecular Formula:

C9H9BrN4S

Molecular Weight:

285.1636

MDL Number:

MFCD11132382

IUPAC Name:

5-bromo-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]aniline

InChI:

InChI=1S/C9H9BrN4S/c1-14-5-12-13-9(14)15-8-3-2-6(10)4-7(8)11/h2-5H,11H2,1H3

InChI Key:

UTROVXWKEAVQQH-UHFFFAOYSA-N

SMILES:

Brc1ccc(c(c1)N)Sc1nncn1C

Complexity:

218

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

283.973g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

285.163g/mol

Monoisotopic Mass:

283.973g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8