D539-0087 Screening compound: N-(8-butoxyquinolin-5-yl)-3-methoxybenzamide

D539-0087 Screening compound: N-(8-butoxyquinolin-5-yl)-3-methoxybenzamide
D539-0087 Screening compound: N-(8-butoxyquinolin-5-yl)-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D539-0087
N-(8-butoxyquinolin-5-yl)-3-methoxybenzamide

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

D539-0087

Molecular Formula

C21H22N2O3 (C21 H22 N2 O3)

Compound Name

N-(8-butoxyquinolin-5-yl)-3-methoxybenzamide

IUPAC name

N-(8-butoxyquinolin-5-yl)-3-methoxybenzamide

SMILES

CCCCOc(c1ncccc11)ccc1NC(c1cc(OC)ccc1)=O

InChI

InChI=1S/C21H22N2O3/c1-3-4-13-26-19-11-10-18(17-9-6-12-22-20(17)19)23-21(24)15-7-5-8-16(14-15)25-2/h5-12,14H,3-4,13H2,1-2H3,(H,23,24)

InChI Key

DRMVLQNGNVQACT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14833494

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.458

Distribution Coefficient, logD

4.457

Water Solubility, LogSw

-4.33

Polar Surface Area

47.213

Acid Dissociation Constant (pKa)

10.84

Base Dissociation Constant (pKb)

4.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with D539-0087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D539-0087?
Check Price and Availability of D539-0087, 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 D539-0087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D539-0087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D539-0087
  • 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 D539-0087 available by request