L498-0646 Screening compound: N-[2-(azepan-1-yl)ethyl]-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]benzamide

L498-0646 Screening compound: N-[2-(azepan-1-yl)ethyl]-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]benzamide
L498-0646 Screening compound: N-[2-(azepan-1-yl)ethyl]-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L498-0646
N-[2-(azepan-1-yl)ethyl]-4-[3-(4-fluorophenyl)-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

L498-0646

Molecular Formula

C23H25FN4O2 (C23 H25 FN4 O2)

Compound Name

N-[2-(azepan-1-yl)ethyl]-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]benzamide

IUPAC name

N-[2-(azepan-1-yl)ethyl]-4-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]benzamide

SMILES

O=C(c(cc1)ccc1-c1nc(-c(cc2)ccc2F)no1)NCCN1CCCCCC1

InChI

InChI=1S/C23H25FN4O2/c24-20-11-9-17(10-12-20)21-26-23(30-27-21)19-7-5-18(6-8-19)22(29)25-13-16-28-14-3-1-2-4-15-28/h5-12H,1-4,13-16H2,(H,25,29)

InChI Key

BGXKUUFLWFYMAQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15128818

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.413

Distribution Coefficient, logD

3.436

Water Solubility, LogSw

-4.14

Polar Surface Area

60.213

Acid Dissociation Constant (pKa)

12.57

Base Dissociation Constant (pKb)

8.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with L498-0646 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L498-0646?
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What is the minimum amount of L498-0646 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L498-0646
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L498-0646
  • 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 L498-0646 available by request