Name: Name:1-(4-benzyl-1,4-diazepan-1-yl)ethan-1-one
Brand: Angene
SKU: AG01AHH1
Rating: 90 (10 reviews)

1-(4-benzyl-1,4-diazepan-1-yl)ethan-1-one

CAS No.:

192869-86-6

Catalog Number:

AG01AHH1

Molecular Formula:

C14H20N2O

Molecular Weight:

232.3214

Catalog Number:

AG01AHH1

Chemical Name:

1-(4-benzyl-1,4-diazepan-1-yl)ethan-1-one

CAS Number:

192869-86-6

Molecular Formula:

C14H20N2O

Molecular Weight:

232.3214

MDL Number:

MFCD25970556

IUPAC Name:

1-(4-benzyl-1,4-diazepan-1-yl)ethanone

InChI:

InChI=1S/C14H20N2O/c1-13(17)16-9-5-8-15(10-11-16)12-14-6-3-2-4-7-14/h2-4,6-7H,5,8-12H2,1H3

InChI Key:

QEMCOILQJHTAEY-UHFFFAOYSA-N

SMILES:

CC(=O)N1CCCN(CC1)Cc1ccccc1

Complexity:

249

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

232.158g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

232.327g/mol

Monoisotopic Mass:

232.158g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

23.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4