L866-0187 Screening compound: 3-(4-{[(4-bromophenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-N-ethylpropanamide

L866-0187 Screening compound: 3-(4-{[(4-bromophenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-N-ethylpropanamide
L866-0187 Screening compound: 3-(4-{[(4-bromophenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-N-ethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L866-0187
3-(4-{[(4-bromophenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-N-ethylpropanamide

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

L866-0187

Molecular Formula

C21H21BrN4O3 (C21 H21 BrN4 O3)

Compound Name

3-(4-{[(4-bromophenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-N-ethylpropanamide

IUPAC name

3-(4-{[(4-bromophenyl)carbamoyl]methyl}-3-oxo-34-dihydroquinoxalin-2-yl)-N-ethylpropanamide

SMILES

CCNC(CCC1=Nc(cccc2)c2N(CC(Nc(cc2)ccc2Br)=O)C1=O)=O

InChI

InChI=1S/C21H21BrN4O3/c1-2-23-19(27)12-11-17-21(29)26(18-6-4-3-5-16(18)25-17)13-20(28)24-15-9-7-14(22)8-10-15/h3-10H,2,11-13H2,1H3,(H,23,27)(H,24,28)

InChI Key

RHQOCNXKOAMTNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27482769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.427

Distribution Coefficient, logD

2.426

Water Solubility, LogSw

-2.84

Polar Surface Area

70.600

Acid Dissociation Constant (pKa)

10.89

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with L866-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L866-0187?
Check Price and Availability of L866-0187, 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 L866-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L866-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L866-0187
  • 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 L866-0187 available by request