L453-0363 Screening compound: N-(3-methoxypropyl)-4-[3-(2-{methyl[(3-methylphenyl)carbamoyl]amino}ethyl)-1,2,4-oxadiazol-5-yl]benzamide

L453-0363 Screening compound: N-(3-methoxypropyl)-4-[3-(2-{methyl[(3-methylphenyl)carbamoyl]amino}ethyl)-1,2,4-oxadiazol-5-yl]benzamide
L453-0363 Screening compound: N-(3-methoxypropyl)-4-[3-(2-{methyl[(3-methylphenyl)carbamoyl]amino}ethyl)-1,2,4-oxadiazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L453-0363
N-(3-methoxypropyl)-4-[3-(2-{methyl[(3-methylphenyl)carbamoyl]amino}ethyl)-1,2,4-oxadiazol-5-yl]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

L453-0363

Molecular Formula

C24H29N5O4 (C24 H29 N5 O4)

Compound Name

N-(3-methoxypropyl)-4-[3-(2-{methyl[(3-methylphenyl)carbamoyl]amino}ethyl)-1,2,4-oxadiazol-5-yl]benzamide

IUPAC name

N-(3-methoxypropyl)-4-[3-(2-{methyl[(3-methylphenyl)carbamoyl]amino}ethyl)-124-oxadiazol-5-yl]benzamide

SMILES

Cc1cccc(NC(N(C)CCc2noc(-c(cc3)ccc3C(NCCCOC)=O)n2)=O)c1

InChI

InChI=1S/C24H29N5O4/c1-17-6-4-7-20(16-17)26-24(31)29(2)14-12-21-27-23(33-28-21)19-10-8-18(9-11-19)22(30)25-13-5-15-32-3/h4,6-11,16H,5,12-15H2,1-3H3,(H,25,30)(H,26,31)

InChI Key

XDCSFDPSGADSQF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27253174

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.975

Distribution Coefficient, logD

2.975

Water Solubility, LogSw

-3.34

Polar Surface Area

90.725

Acid Dissociation Constant (pKa)

13.67

Base Dissociation Constant (pKb)

-0.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

L453-0363 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with L453-0363 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L453-0363?
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What is the minimum amount of L453-0363 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L453-0363
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L453-0363
  • 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 L453-0363 available by request