G411-0330 Screening compound: N-{4-[(cyclohexylmethyl)amino]-2-oxo-2H-chromen-3-yl}-2-fluorobenzamide

G411-0330 Screening compound: N-{4-[(cyclohexylmethyl)amino]-2-oxo-2H-chromen-3-yl}-2-fluorobenzamide
G411-0330 Screening compound: N-{4-[(cyclohexylmethyl)amino]-2-oxo-2H-chromen-3-yl}-2-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G411-0330
N-{4-[(cyclohexylmethyl)amino]-2-oxo-2H-chromen-3-yl}-2-fluorobenzamide

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

G411-0330

Molecular Formula

C23H23FN2O3 (C23 H23 FN2 O3)

Compound Name

N-{4-[(cyclohexylmethyl)amino]-2-oxo-2H-chromen-3-yl}-2-fluorobenzamide

IUPAC name

N-{4-[(cyclohexylmethyl)amino]-2-oxo-2H-chromen-3-yl}-2-fluorobenzamide

SMILES

O=C(c(cccc1)c1F)NC(C(Oc1c2cccc1)=O)=C2NCC1CCCCC1

InChI

InChI=1S/C23H23FN2O3/c24-18-12-6-4-10-16(18)22(27)26-21-20(25-14-15-8-2-1-3-9-15)17-11-5-7-13-19(17)29-23(21)28/h4-7,10-13,15,25H,1-3,8-9,14H2,(H,26,27)

InChI Key

KXSXYGNHBBECQB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27139791

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.349

Distribution Coefficient, logD

3.044

Water Solubility, LogSw

-4.65

Polar Surface Area

55.076

Acid Dissociation Constant (pKa)

6.12

Base Dissociation Constant (pKb)

-3.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

G411-0330 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G411-0330 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G411-0330?
Check Price and Availability of G411-0330, 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 G411-0330 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G411-0330
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G411-0330
  • 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 G411-0330 available by request