G634-0562 Screening compound: 6-bromo-1-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-1,2,3,4-tetrahydroquinolin-2-one

G634-0562 Screening compound: 6-bromo-1-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-1,2,3,4-tetrahydroquinolin-2-one
G634-0562 Screening compound: 6-bromo-1-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-1,2,3,4-tetrahydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G634-0562
6-bromo-1-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-1,2,3,4-tetrahydroquinolin-2-one

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

G634-0562

Molecular Formula

C19H20BrN5O2 (C19 H20 BrN5 O2)

Compound Name

6-bromo-1-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-1,2,3,4-tetrahydroquinolin-2-one

IUPAC name

6-bromo-1-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-1234-tetrahydroquinolin-2-one

SMILES

O=C(CN(C(CC1)=O)c(cc2)c1cc2Br)N(CC1)CCN1c1ncccn1

InChI

InChI=1S/C19H20BrN5O2/c20-15-3-4-16-14(12-15)2-5-17(26)25(16)13-18(27)23-8-10-24(11-9-23)19-21-6-1-7-22-19/h1,3-4,6-7,12H,2,5,8-11,13H2

InChI Key

GJEWSNRGKZVZSY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15023980

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.639

Distribution Coefficient, logD

2.639

Water Solubility, LogSw

-2.92

Polar Surface Area

53.634

Acid Dissociation Constant (pKa)

21.02

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

G634-0562 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G634-0562 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G634-0562?
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What is the minimum amount of G634-0562 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G634-0562
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G634-0562
  • 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 G634-0562 available by request