Name: Name:1-[(5-chloro-1-methyl-1H-imidazol-2-yl)methyl]-1,4-diazepane
Brand: Angene
SKU: AG01ABB5
Rating: 90 (10 reviews)

1-[(5-chloro-1-methyl-1H-imidazol-2-yl)methyl]-1,4-diazepane

CAS No.:

1094226-29-5

Catalog Number:

AG01ABB5

Molecular Formula:

C10H17ClN4

Molecular Weight:

228.7218

Catalog Number:

AG01ABB5

Chemical Name:

1-[(5-chloro-1-methyl-1H-imidazol-2-yl)methyl]-1,4-diazepane

CAS Number:

1094226-29-5

Molecular Formula:

C10H17ClN4

Molecular Weight:

228.7218

MDL Number:

MFCD11182309

IUPAC Name:

1-[(5-chloro-1-methylimidazol-2-yl)methyl]-1,4-diazepane

InChI:

InChI=1S/C10H17ClN4/c1-14-9(11)7-13-10(14)8-15-5-2-3-12-4-6-15/h7,12H,2-6,8H2,1H3

InChI Key:

OHIKHQREQDROBU-UHFFFAOYSA-N

SMILES:

Clc1cnc(n1C)CN1CCNCCC1

Complexity:

202

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

228.114g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

228.724g/mol

Monoisotopic Mass:

228.114g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

33.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5