D704-0068 Screening compound: 8-methyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[(3-methylphenyl)methyl]quinolin-2-amine

D704-0068 Screening compound: 8-methyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[(3-methylphenyl)methyl]quinolin-2-amine
D704-0068 Screening compound: 8-methyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[(3-methylphenyl)methyl]quinolin-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D704-0068
8-methyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[(3-methylphenyl)methyl]quinolin-2-amine

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

D704-0068

Molecular Formula

C21H20N4O (C21 H20 N4 O)

Compound Name

8-methyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[(3-methylphenyl)methyl]quinolin-2-amine

IUPAC name

8-methyl-3-(5-methyl-124-oxadiazol-3-yl)-N-[(3-methylphenyl)methyl]quinolin-2-amine

SMILES

Cc1nc(-c2cc3cccc(C)c3nc2NCc2cc(C)ccc2)no1

InChI

InChI=1S/C21H20N4O/c1-13-6-4-8-16(10-13)12-22-20-18(21-23-15(3)26-25-21)11-17-9-5-7-14(2)19(17)24-20/h4-11H,12H2,1-3H3,(H,22,24)

InChI Key

NUMZYYDUGUZFHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27597072

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.366

Distribution Coefficient, logD

4.447

Water Solubility, LogSw

-6.37

Polar Surface Area

51.119

Acid Dissociation Constant (pKa)

18.24

Base Dissociation Constant (pKb)

8.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

D704-0068 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D704-0068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D704-0068?
Check Price and Availability of D704-0068, 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 D704-0068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D704-0068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D704-0068
  • 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 D704-0068 available by request