3366-5399 Screening compound: 1,3-dimethyl 5-[2-(4-ethylphenyl)quinoline-4-amido]benzene-1,3-dicarboxylate

3366-5399 Screening compound: 1,3-dimethyl 5-[2-(4-ethylphenyl)quinoline-4-amido]benzene-1,3-dicarboxylate
3366-5399 Screening compound: 1,3-dimethyl 5-[2-(4-ethylphenyl)quinoline-4-amido]benzene-1,3-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3366-5399
1,3-dimethyl 5-[2-(4-ethylphenyl)quinoline-4-amido]benzene-1,3-dicarboxylate

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

3366-5399

Molecular Formula

C28H24N2O5 (C28 H24 N2 O5)

Compound Name

1,3-dimethyl 5-[2-(4-ethylphenyl)quinoline-4-amido]benzene-1,3-dicarboxylate

IUPAC name

13-dimethyl 5-[2-(4-ethylphenyl)quinoline-4-amido]benzene-13-dicarboxylate

SMILES

CCc(cc1)ccc1-c1nc2ccccc2c(C(Nc2cc(C(OC)=O)cc(C(OC)=O)c2)=O)c1

InChI

InChI=1S/C28H24N2O5/c1-4-17-9-11-18(12-10-17)25-16-23(22-7-5-6-8-24(22)30-25)26(31)29-21-14-19(27(32)34-2)13-20(15-21)28(33)35-3/h5-16H,4H2,1-3H3,(H,29,31)

InChI Key

TWIGOKQIXDTRHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01356091

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.975

Distribution Coefficient, logD

6.975

Water Solubility, LogSw

-5.97

Polar Surface Area

73.737

Acid Dissociation Constant (pKa)

11.76

Base Dissociation Constant (pKb)

2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with 3366-5399 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3366-5399?
Check Price and Availability of 3366-5399, 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 3366-5399 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3366-5399
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3366-5399
  • 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 3366-5399 available by request