Name: Name:7-BROMO-5-(4-FLUOROPHENYL)-1,3,4,5-TETRAHYDRO-2H-1,4-BENZODIAZEPIN-2-ONE
Brand: Angene
SKU: AG01AQZ1
Rating: 90 (10 reviews)

7-BROMO-5-(4-FLUOROPHENYL)-1,3,4,5-TETRAHYDRO-2H-1,4-BENZODIAZEPIN-2-ONE

CAS No.:

887201-54-9

Catalog Number:

AG01AQZ1

Molecular Formula:

C15H12BrFN2O

Molecular Weight:

335.1710

Catalog Number:

AG01AQZ1

Chemical Name:

7-BROMO-5-(4-FLUOROPHENYL)-1,3,4,5-TETRAHYDRO-2H-1,4-BENZODIAZEPIN-2-ONE

CAS Number:

887201-54-9

Molecular Formula:

C15H12BrFN2O

Molecular Weight:

335.1710

MDL Number:

MFCD04444687

IUPAC Name:

7-bromo-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-1,4-benzodiazepin-2-one

InChI:

InChI=1S/C15H12BrFN2O/c16-10-3-6-13-12(7-10)15(18-8-14(20)19-13)9-1-4-11(17)5-2-9/h1-7,15,18H,8H2,(H,19,20)

InChI Key:

DWFUKXRQQRNGHQ-UHFFFAOYSA-N

SMILES:

O=C1CNC(c2c(N1)ccc(c2)Br)c1ccc(cc1)F

Complexity:

360

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

334.012g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

335.176g/mol

Monoisotopic Mass:

334.012g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8