L662-0616 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}benzamide

L662-0616 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}benzamide
L662-0616 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L662-0616
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}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

L662-0616

Molecular Formula

C25H24FN3O2 (C25 H24 FN3 O2)

Compound Name

N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}benzamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[2-(4-fluorophenyl)pyrimidin-4-yl]oxy}benzamide

SMILES

O=C(c(cc1)ccc1Oc1ccnc(-c(cc2)ccc2F)n1)NCCC1=CCCCC1

InChI

InChI=1S/C25H24FN3O2/c26-21-10-6-19(7-11-21)24-27-17-15-23(29-24)31-22-12-8-20(9-13-22)25(30)28-16-14-18-4-2-1-3-5-18/h4,6-13,15,17H,1-3,5,14,16H2,(H,28,30)

InChI Key

QETWAZITDZNJLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27467725

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.604

Distribution Coefficient, logD

4.604

Water Solubility, LogSw

-4.56

Polar Surface Area

50.065

Acid Dissociation Constant (pKa)

14.04

Base Dissociation Constant (pKb)

2.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

L662-0616 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with L662-0616 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L662-0616?
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What is the minimum amount of L662-0616 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L662-0616
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L662-0616
  • 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 L662-0616 available by request