L084-0804 Screening compound: 4-(3-{2-[N-methyl-1-(4-methylphenyl)formamido]ethyl}-1,2,4-oxadiazol-5-yl)-N-[3-(pyrrolidin-1-yl)butyl]benzamide

L084-0804 Screening compound: 4-(3-{2-[N-methyl-1-(4-methylphenyl)formamido]ethyl}-1,2,4-oxadiazol-5-yl)-N-[3-(pyrrolidin-1-yl)butyl]benzamide
L084-0804 Screening compound: 4-(3-{2-[N-methyl-1-(4-methylphenyl)formamido]ethyl}-1,2,4-oxadiazol-5-yl)-N-[3-(pyrrolidin-1-yl)butyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L084-0804
4-(3-{2-[N-methyl-1-(4-methylphenyl)formamido]ethyl}-1,2,4-oxadiazol-5-yl)-N-[3-(pyrrolidin-1-yl)butyl]benzamide

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

L084-0804

Molecular Formula

C28H35N5O3 (C28 H35 N5 O3)

Compound Name

4-(3-{2-[N-methyl-1-(4-methylphenyl)formamido]ethyl}-1,2,4-oxadiazol-5-yl)-N-[3-(pyrrolidin-1-yl)butyl]benzamide

IUPAC name

4-(3-{2-[N-methyl-1-(4-methylphenyl)formamido]ethyl}-124-oxadiazol-5-yl)-N-[3-(pyrrolidin-1-yl)butyl]benzamide

SMILES

CC(CCNC(c(cc1)ccc1-c1nc(CCN(C)C(c2ccc(C)cc2)=O)no1)=O)N1CCCC1

InChI

InChI=1S/C28H35N5O3/c1-20-6-8-24(9-7-20)28(35)32(3)19-15-25-30-27(36-31-25)23-12-10-22(11-13-23)26(34)29-16-14-21(2)33-17-4-5-18-33/h6-13,21H,4-5,14-19H2,1-3H3,(H,29,34)/t21-/m0/s1

InChI Key

FWDZNJLNZPSVQJ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD27229718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

489.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.992

Distribution Coefficient, logD

-0.402

Water Solubility, LogSw

-3.34

Polar Surface Area

77.297

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

10.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

L084-0804 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L084-0804 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L084-0804?
Check Price and Availability of L084-0804, 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 L084-0804 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L084-0804
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L084-0804
  • 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 L084-0804 available by request