Name: Name:1,3,3-trimethyl-1,2,3,4-tetrahydroquinoxalin-2-one
Brand: Angene
SKU: AG01BXXF
Rating: 90 (10 reviews)

1,3,3-trimethyl-1,2,3,4-tetrahydroquinoxalin-2-one

CAS No.:

91180-82-4

Catalog Number:

AG01BXXF

Molecular Formula:

C11H14N2O

Molecular Weight:

190.2417

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Product Description

Catalog Number:

AG01BXXF

Chemical Name:

1,3,3-trimethyl-1,2,3,4-tetrahydroquinoxalin-2-one

CAS Number:

91180-82-4

Molecular Formula:

C11H14N2O

Molecular Weight:

190.2417

MDL Number:

MFCD00839427

IUPAC Name:

1,3,3-trimethyl-4H-quinoxalin-2-one

InChI:

InChI=1S/C11H14N2O/c1-11(2)10(14)13(3)9-7-5-4-6-8(9)12-11/h4-7,12H,1-3H3

InChI Key:

NJNXNAWEVLDAOW-UHFFFAOYSA-N

SMILES:

CN1c2ccccc2NC(C1=O)(C)C

Properties

Complexity:

250

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

190.111g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

190.246g/mol

Monoisotopic Mass:

190.111g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

32.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101