D704-0363 Screening compound: N-[8-methyl-3-(5-propyl-1,2,4-oxadiazol-3-yl)-2-quinolyl]-N-(3-pyridylmethyl)amine

D704-0363 Screening compound: N-[8-methyl-3-(5-propyl-1,2,4-oxadiazol-3-yl)-2-quinolyl]-N-(3-pyridylmethyl)amine
D704-0363 Screening compound: N-[8-methyl-3-(5-propyl-1,2,4-oxadiazol-3-yl)-2-quinolyl]-N-(3-pyridylmethyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D704-0363
N-[8-methyl-3-(5-propyl-1,2,4-oxadiazol-3-yl)-2-quinolyl]-N-(3-pyridylmethyl)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

D704-0363

Molecular Formula

C21H21N5O (C21 H21 N5 O)

Compound Name

N-[8-methyl-3-(5-propyl-1,2,4-oxadiazol-3-yl)-2-quinolyl]-N-(3-pyridylmethyl)amine

IUPAC name

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

SMILES

CCCc1nc(-c2cc3cccc(C)c3nc2NCc2cnccc2)no1

InChI

InChI=1S/C21H21N5O/c1-3-6-18-24-21(26-27-18)17-11-16-9-4-7-14(2)19(16)25-20(17)23-13-15-8-5-10-22-12-15/h4-5,7-12H,3,6,13H2,1-2H3,(H,23,25)

InChI Key

NNVMVQVEOCLSKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27597100

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.640

Distribution Coefficient, logD

3.391

Water Solubility, LogSw

-4.85

Polar Surface Area

61.075

Acid Dissociation Constant (pKa)

17.76

Base Dissociation Constant (pKb)

8.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.81

D704-0363 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with D704-0363 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D704-0363?
Check Price and Availability of D704-0363, 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 D704-0363 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D704-0363
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D704-0363
  • 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 D704-0363 available by request