L485-2202 Screening compound: N-(3-fluorophenyl)-6-methyl-2-(pyrrolidine-1-carbonyl)quinolin-4-amine

L485-2202 Screening compound: N-(3-fluorophenyl)-6-methyl-2-(pyrrolidine-1-carbonyl)quinolin-4-amine
L485-2202 Screening compound: N-(3-fluorophenyl)-6-methyl-2-(pyrrolidine-1-carbonyl)quinolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound L485-2202
N-(3-fluorophenyl)-6-methyl-2-(pyrrolidine-1-carbonyl)quinolin-4-amine

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

L485-2202

Molecular Formula

C21H20FN3O (C21 H20 FN3 O)

Compound Name

N-(3-fluorophenyl)-6-methyl-2-(pyrrolidine-1-carbonyl)quinolin-4-amine

IUPAC name

N-(3-fluorophenyl)-6-methyl-2-(pyrrolidine-1-carbonyl)quinolin-4-amine

SMILES

Cc(cc1c(Nc2cccc(F)c2)c2)ccc1nc2C(N1CCCC1)=O

InChI

InChI=1S/C21H20FN3O/c1-14-7-8-18-17(11-14)19(23-16-6-4-5-15(22)12-16)13-20(24-18)21(26)25-9-2-3-10-25/h4-8,11-13H,2-3,9-10H2,1H3,(H,23,24)

InChI Key

TYLYGPQBQZWYRG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27456726

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.309

Distribution Coefficient, logD

5.309

Water Solubility, LogSw

-5.38

Polar Surface Area

33.798

Acid Dissociation Constant (pKa)

17.72

Base Dissociation Constant (pKb)

3.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

L485-2202 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with L485-2202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L485-2202?
Check Price and Availability of L485-2202, 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 L485-2202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L485-2202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L485-2202
  • 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 L485-2202 available by request