Name: Name:6-(bromomethyl)-3-phenyl-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazole
Brand: Angene
SKU: AG01AV2V
Rating: 90 (10 reviews)

6-(bromomethyl)-3-phenyl-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazole

CAS No.:

742004-46-2

Catalog Number:

AG01AV2V

Molecular Formula:

C11H10BrN3S

Molecular Weight:

296.1862

Catalog Number:

AG01AV2V

Chemical Name:

6-(bromomethyl)-3-phenyl-5H,6H-[1,2,4]triazolo[3,4-b][1,3]thiazole

CAS Number:

742004-46-2

Molecular Formula:

C11H10BrN3S

Molecular Weight:

296.1862

MDL Number:

MFCD27959442

IUPAC Name:

6-(bromomethyl)-3-phenyl-5,6-dihydro-[1,3]thiazolo[2,3-c][1,2,4]triazole

InChI:

InChI=1S/C11H10BrN3S/c12-6-9-7-15-10(13-14-11(15)16-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2

InChI Key:

ALFGOQIZSNTHCA-UHFFFAOYSA-N

SMILES:

BrCC1Cn2c(S1)nnc2c1ccccc1

Complexity:

247

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

294.978g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

296.186g/mol

Monoisotopic Mass:

294.978g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

56A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5