L438-0025 Screening compound: 1-(5-chloro-2,4-dimethoxyphenyl)-3-[8-fluoro-2-(pyrrolidin-1-yl)quinolin-6-yl]urea

L438-0025 Screening compound: 1-(5-chloro-2,4-dimethoxyphenyl)-3-[8-fluoro-2-(pyrrolidin-1-yl)quinolin-6-yl]urea
L438-0025 Screening compound: 1-(5-chloro-2,4-dimethoxyphenyl)-3-[8-fluoro-2-(pyrrolidin-1-yl)quinolin-6-yl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L438-0025
1-(5-chloro-2,4-dimethoxyphenyl)-3-[8-fluoro-2-(pyrrolidin-1-yl)quinolin-6-yl]urea

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

L438-0025

Molecular Formula

C22H22ClFN4O3 (C22 H22 ClFN4 O3)

Compound Name

1-(5-chloro-2,4-dimethoxyphenyl)-3-[8-fluoro-2-(pyrrolidin-1-yl)quinolin-6-yl]urea

IUPAC name

1-(5-chloro-24-dimethoxyphenyl)-3-[8-fluoro-2-(pyrrolidin-1-yl)quinolin-6-yl]urea

SMILES

COc(c(NC(Nc1cc2ccc(N3CCCC3)nc2c(F)c1)=O)c1)cc(OC)c1Cl

InChI

InChI=1S/C22H22ClFN4O3/c1-30-18-12-19(31-2)17(11-15(18)23)26-22(29)25-14-9-13-5-6-20(28-7-3-4-8-28)27-21(13)16(24)10-14/h5-6,9-12H,3-4,7-8H2,1-2H3,(H2,25,26,29)

InChI Key

VTXOPHVHNIKECA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27252640

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.89

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.591

Distribution Coefficient, logD

5.575

Water Solubility, LogSw

-5.98

Polar Surface Area

59.488

Acid Dissociation Constant (pKa)

8.83

Base Dissociation Constant (pKb)

3.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

L438-0025 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with L438-0025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L438-0025?
Check Price and Availability of L438-0025, 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 L438-0025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L438-0025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L438-0025
  • 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 L438-0025 available by request