Name: Name:1-benzyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-one
Brand: Angene
SKU: AG01AK76
Rating: 90 (10 reviews)

1-benzyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-one

CAS No.:

1333691-32-9

Catalog Number:

AG01AK76

Molecular Formula:

C16H16N2O

Molecular Weight:

252.3110

Catalog Number:

AG01AK76

Chemical Name:

1-benzyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-2-one

CAS Number:

1333691-32-9

Molecular Formula:

C16H16N2O

Molecular Weight:

252.3110

MDL Number:

MFCD19982451

IUPAC Name:

5-benzyl-2,3-dihydro-1H-1,5-benzodiazepin-4-one

InChI:

InChI=1S/C16H16N2O/c19-16-10-11-17-14-8-4-5-9-15(14)18(16)12-13-6-2-1-3-7-13/h1-9,17H,10-12H2

InChI Key:

MGNXCDZKEQFDQT-UHFFFAOYSA-N

SMILES:

O=C1CCNc2c(N1Cc1ccccc1)cccc2

Complexity:

312

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

252.126g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

252.317g/mol

Monoisotopic Mass:

252.126g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

32.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5