Name: Name:5-(2-{6-chloro-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}ethyl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole
Brand: Angene
SKU: AG01BECU
Rating: 90 (10 reviews)

5-(2-{6-chloro-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}ethyl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole

CAS No.:

1803571-27-8

Catalog Number:

AG01BECU

Molecular Formula:

C16H13ClN6O2

Molecular Weight:

356.7664

Catalog Number:

AG01BECU

Chemical Name:

5-(2-{6-chloro-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}ethyl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole

CAS Number:

1803571-27-8

Molecular Formula:

C16H13ClN6O2

Molecular Weight:

356.7664

MDL Number:

MFCD28118327

IUPAC Name:

5-[2-(6-chloro-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole

InChI:

InChI=1S/C16H13ClN6O2/c1-24-11-5-3-2-4-10(11)16-18-15(25-22-16)9-8-14-20-19-13-7-6-12(17)21-23(13)14/h2-7H,8-9H2,1H3

InChI Key:

SVDGHRYRACHNOM-UHFFFAOYSA-N

SMILES:

COc1ccccc1c1noc(n1)CCc1nnc2n1nc(Cl)cc2

Complexity:

447

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

356.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

356.77g/mol

Monoisotopic Mass:

356.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8