CAS 17518-85-3 | 4(3H)-Quinazolinone, 6,8-dibromo- | CAS Number 17518-85-3

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17518-85-3 | 4(3H)-Quinazolinone, 6,8-dibromo-

CAS No: 17518-85-3 Catalog No: AG0020DQ MDL No:MFCD03854537

Product Description

Catalog Number:

AG0020DQ

Chemical Name:

4(3H)-Quinazolinone, 6,8-dibromo-

CAS Number:

17518-85-3

Molecular Formula:

C8H4Br2N2O

Molecular Weight:

303.9382

MDL Number:

MFCD03854537

IUPAC Name:

6,8-dibromo-3H-quinazolin-4-one

InChI:

InChI=1S/C8H4Br2N2O/c9-4-1-5-7(6(10)2-4)11-3-12-8(5)13/h1-3H,(H,11,12,13)

InChI Key:

PCUXMFPULVMCQM-UHFFFAOYSA-N

SMILES:

Brc1cc(Br)c2c(c1)c(=O)[nH]cn2

Properties

Complexity:

257

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

303.867g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

303.941g/mol

Monoisotopic Mass:

301.869g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1

Literature

Title	Journal
Novel 6,8-dibromo-4(3H)quinazolinone derivatives of anti-bacterial and anti-fungal activities.	European journal of medicinal chemistry 20100801
Novel 6,8-dibromo-4(3H)-quinazolinone derivatives of promising anti-inflammatory and analgesic properties.	Acta poloniae pharmaceutica 20100101