Name: Name:2-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]azepane hydrochloride
Brand: Angene
SKU: AG01A71P
Rating: 90 (10 reviews)

2-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]azepane hydrochloride

CAS No.:

1461713-91-6

Catalog Number:

AG01A71P

Molecular Formula:

C11H20ClN3O

Molecular Weight:

245.7490

Catalog Number:

AG01A71P

Chemical Name:

2-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]azepane hydrochloride

CAS Number:

1461713-91-6

Molecular Formula:

C11H20ClN3O

Molecular Weight:

245.7490

MDL Number:

MFCD25970508

IUPAC Name:

3-(azepan-2-yl)-5-propan-2-yl-1,2,4-oxadiazole;hydrochloride

InChI:

InChI=1S/C11H19N3O.ClH/c1-8(2)11-13-10(14-15-11)9-6-4-3-5-7-12-9;/h8-9,12H,3-7H2,1-2H3;1H

InChI Key:

OFCPXQYZJVKYLQ-UHFFFAOYSA-N

SMILES:

CC(c1onc(n1)C1CCCCCN1)C.Cl

Complexity:

198

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

245.129g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

245.751g/mol

Monoisotopic Mass:

245.129g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: