G406-0168 Screening compound: 1-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-2-one

G406-0168 Screening compound: 1-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-2-one
G406-0168 Screening compound: 1-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G406-0168
1-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-6-(pyrrolidine-1-sulfonyl)-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

G406-0168

Molecular Formula

C23H28N6O4S (C23 H28 N6 O4 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(CN(C(CC1)=O)c(cc2)c1cc2S(N1CCCC1)(=O)=O)N(CC1)CCN1c1ncccn1

InChI

InChI=1S/C23H28N6O4S/c30-21-7-4-18-16-19(34(32,33)28-10-1-2-11-28)5-6-20(18)29(21)17-22(31)26-12-14-27(15-13-26)23-24-8-3-9-25-23/h3,5-6,8-9,16H,1-2,4,7,10-15,17H2

InChI Key

CZFSWFVGDIFWAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27139286

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.58

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.809

Distribution Coefficient, logD

1.809

Water Solubility, LogSw

-2.63

Polar Surface Area

85.711

Acid Dissociation Constant (pKa)

21.02

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

G406-0168 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G406-0168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G406-0168?
Check Price and Availability of G406-0168, 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 G406-0168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G406-0168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G406-0168
  • 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 G406-0168 available by request