0422-0033 Screening compound: 8-hydroxy-5,7-dimethylquinoline-2-carbaldehyde

0422-0033 Screening compound: 8-hydroxy-5,7-dimethylquinoline-2-carbaldehyde
0422-0033 Screening compound: 8-hydroxy-5,7-dimethylquinoline-2-carbaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound 0422-0033
8-hydroxy-5,7-dimethylquinoline-2-carbaldehyde

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

0422-0033

Molecular Formula

C12H11NO2 (C12 H11 NO2)

Compound Name

8-hydroxy-5,7-dimethylquinoline-2-carbaldehyde

IUPAC name

8-hydroxy-57-dimethylquinoline-2-carbaldehyde

SMILES

Cc(cc1C)c(ccc(C=O)n2)c2c1O

InChI

InChI=1S/C12H11NO2/c1-7-5-8(2)12(15)11-10(7)4-3-9(6-14)13-11/h3-6,15H,1-2H3

InChI Key

XEIMFKGDSXIMHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00168963

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

201.22

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.711

Distribution Coefficient, logD

2.710

Water Solubility, LogSw

-2.48

Polar Surface Area

39.473

Acid Dissociation Constant (pKa)

10.13

Base Dissociation Constant (pKb)

3.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

0422-0033 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 0422-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0422-0033?
Check Price and Availability of 0422-0033, 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 0422-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0422-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0422-0033
  • 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 0422-0033 available by request