L453-0279 Screening compound: 4-[3-(2-{[(2-methoxyphenyl)carbamoyl](methyl)amino}ethyl)-1,2,4-oxadiazol-5-yl]-N-[(3-methylphenyl)methyl]benzamide

L453-0279 Screening compound: 4-[3-(2-{[(2-methoxyphenyl)carbamoyl](methyl)amino}ethyl)-1,2,4-oxadiazol-5-yl]-N-[(3-methylphenyl)methyl]benzamide
L453-0279 Screening compound: 4-[3-(2-{[(2-methoxyphenyl)carbamoyl](methyl)amino}ethyl)-1,2,4-oxadiazol-5-yl]-N-[(3-methylphenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L453-0279
4-[3-(2-{[(2-methoxyphenyl)carbamoyl](methyl)amino}ethyl)-1,2,4-oxadiazol-5-yl]-N-[(3-methylphenyl)methyl]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

L453-0279

Molecular Formula

C28H29N5O4 (C28 H29 N5 O4)

Compound Name

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

IUPAC name

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

SMILES

Cc1cccc(CNC(c(cc2)ccc2-c2nc(CCN(C)C(Nc(cccc3)c3OC)=O)no2)=O)c1

InChI

InChI=1S/C28H29N5O4/c1-19-7-6-8-20(17-19)18-29-26(34)21-11-13-22(14-12-21)27-31-25(32-37-27)15-16-33(2)28(35)30-23-9-4-5-10-24(23)36-3/h4-14,17H,15-16,18H2,1-3H3,(H,29,34)(H,30,35)

InChI Key

FLHWFUFESRQZCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27253145

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.760

Distribution Coefficient, logD

4.760

Water Solubility, LogSw

-4.47

Polar Surface Area

89.202

Acid Dissociation Constant (pKa)

11.78

Base Dissociation Constant (pKb)

-0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with L453-0279 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L453-0279?
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What is the minimum amount of L453-0279 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L453-0279
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L453-0279
  • 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 L453-0279 available by request