Name: Name:3-methyl-1-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1H-imidazol-3-ium iodide
Brand: Angene
SKU: AG019QRG
Rating: 90 (10 reviews)

3-methyl-1-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1H-imidazol-3-ium iodide

CAS No.:

1231959-23-1

Catalog Number:

AG019QRG

Molecular Formula:

C14H18IN5O

Molecular Weight:

399.2301

Catalog Number:

AG019QRG

Chemical Name:

3-methyl-1-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1H-imidazol-3-ium iodide

CAS Number:

1231959-23-1

Molecular Formula:

C14H18IN5O

Molecular Weight:

399.2301

MDL Number:

MFCD11099750

IUPAC Name:

(3-methylimidazol-3-ium-1-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone;iodide

InChI:

InChI=1S/C14H18N5O.HI/c1-16-6-7-19(12-16)14(20)18-10-8-17(9-11-18)13-4-2-3-5-15-13;/h2-7,12H,8-11H2,1H3;1H/q+1;/p-1

InChI Key:

UTUSCAUAIQXEJY-UHFFFAOYSA-M

SMILES:

C[n+]1ccn(c1)C(=O)N1CCN(CC1)c1ccccn1.[I-]

Complexity:

343

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

399.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

399.236g/mol

Monoisotopic Mass:

399.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

45.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: