8014-5127 Screening compound: 4-(bromomethyl)-2(1H)-quinolinone

8014-5127 Screening compound: 4-(bromomethyl)-2(1H)-quinolinone
8014-5127 Screening compound: 4-(bromomethyl)-2(1H)-quinolinone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-5127
4-(bromomethyl)-2(1H)-quinolinone

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8014-5127

Molecular Formula

C10H8BrNO (C10 H8 BrNO)

Compound Name

4-(bromomethyl)-2(1H)-quinolinone

IUPAC name

n/a

SMILES

O=C1Nc(cccc2)c2C(CBr)=C1

InChI

InChI=1S/C10H8BrNO/c11-6-7-5-10(13)12-9-4-2-1-3-8(7)9/h1-5H,6H2,(H,12,13)

InChI Key

BBAHJCUCNVVEQU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03426152

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

238.08

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.299

Distribution Coefficient, logD

2.298

Water Solubility, LogSw

-3.08

Polar Surface Area

25.059

Acid Dissociation Constant (pKa)

10.28

Base Dissociation Constant (pKb)

-2.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

8014-5127 in Drug Discovery

Included in Screening Libraries

Crystallographic and 19F NMR fragment-libraries (624 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8014-5127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-5127?
Check Price and Availability of 8014-5127, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8014-5127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-5127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-5127
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8014-5127 available by request