G491-0409 Screening compound: 3-(2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-amido)benzoic acid

G491-0409 Screening compound: 3-(2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-amido)benzoic acid
G491-0409 Screening compound: 3-(2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-amido)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound G491-0409
3-(2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-amido)benzoic acid

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

G491-0409

Molecular Formula

C17H14N2O5 (C17 H14 N2 O5)

Compound Name

3-(2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-amido)benzoic acid

IUPAC name

3-(25-dioxo-125678-hexahydroquinoline-3-amido)benzoic acid

SMILES

OC(c1cccc(NC(C2=CC(C(CCC3)=O)=C3NC2=O)=O)c1)=O

InChI

InChI=1S/C17H14N2O5/c20-14-6-2-5-13-11(14)8-12(16(22)19-13)15(21)18-10-4-1-3-9(7-10)17(23)24/h1,3-4,7-8H,2,5-6H2,(H,18,21)(H,19,22)(H,23,24)

InChI Key

LWTOXMSTKFTXQZ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.31

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.772

Distribution Coefficient, logD

-1.428

Water Solubility, LogSw

-2.19

Polar Surface Area

89.834

Acid Dissociation Constant (pKa)

4.20

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with G491-0409 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G491-0409?
Check Price and Availability of G491-0409, 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 G491-0409 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G491-0409
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G491-0409
  • 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 G491-0409 available by request