G502-0085 Screening compound: N-(1-cyclopropanecarbonyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(2-fluorophenoxy)acetamide

G502-0085 Screening compound: N-(1-cyclopropanecarbonyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(2-fluorophenoxy)acetamide
G502-0085 Screening compound: N-(1-cyclopropanecarbonyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(2-fluorophenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G502-0085
N-(1-cyclopropanecarbonyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(2-fluorophenoxy)acetamide

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

G502-0085

Molecular Formula

C21H21FN2O3 (C21 H21 FN2 O3)

Compound Name

N-(1-cyclopropanecarbonyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(2-fluorophenoxy)acetamide

IUPAC name

N-(1-cyclopropanecarbonyl-1234-tetrahydroquinolin-6-yl)-2-(2-fluorophenoxy)acetamide

SMILES

O=C(COc(cccc1)c1F)Nc(cc1)cc(CCC2)c1N2C(C1CC1)=O

InChI

InChI=1S/C21H21FN2O3/c22-17-5-1-2-6-19(17)27-13-20(25)23-16-9-10-18-15(12-16)4-3-11-24(18)21(26)14-7-8-14/h1-2,5-6,9-10,12,14H,3-4,7-8,11,13H2,(H,23,25)

InChI Key

HJGZPQQRBZYPII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08006144

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.484

Distribution Coefficient, logD

3.484

Water Solubility, LogSw

-3.76

Polar Surface Area

46.538

Acid Dissociation Constant (pKa)

12.66

Base Dissociation Constant (pKb)

3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G502-0085 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G502-0085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G502-0085?
Check Price and Availability of G502-0085, 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 G502-0085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G502-0085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G502-0085
  • 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 G502-0085 available by request