Name: Name:2-hydroxy-3-[4-(propan-2-yl)phenyl]-3,4-dihydroquinazolin-4-one
Brand: Angene
SKU: AG019OOK
Rating: 90 (10 reviews)

2-hydroxy-3-[4-(propan-2-yl)phenyl]-3,4-dihydroquinazolin-4-one

CAS No.:

870692-98-1

Catalog Number:

AG019OOK

Molecular Formula:

C17H16N2O2

Molecular Weight:

280.3211

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Product Description

Catalog Number:

AG019OOK

Chemical Name:

2-hydroxy-3-[4-(propan-2-yl)phenyl]-3,4-dihydroquinazolin-4-one

CAS Number:

870692-98-1

Molecular Formula:

C17H16N2O2

Molecular Weight:

280.3211

MDL Number:

MFCD06655867

IUPAC Name:

3-(4-propan-2-ylphenyl)-1H-quinazoline-2,4-dione

InChI:

InChI=1S/C17H16N2O2/c1-11(2)12-7-9-13(10-8-12)19-16(20)14-5-3-4-6-15(14)18-17(19)21/h3-11H,1-2H3,(H,18,21)

InChI Key:

ZUAKYEINYRAVOG-UHFFFAOYSA-N

SMILES:

CC(c1ccc(cc1)n1c(O)nc2c(c1=O)cccc2)C

Properties

Complexity:

413

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

280.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

280.327g/mol

Monoisotopic Mass:

280.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3

Literature

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