7430-0008 Screening compound: 3-(2-chlorophenyl)-8-[(2,6-dimethylmorpholin-4-yl)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one

7430-0008 Screening compound: 3-(2-chlorophenyl)-8-[(2,6-dimethylmorpholin-4-yl)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one
7430-0008 Screening compound: 3-(2-chlorophenyl)-8-[(2,6-dimethylmorpholin-4-yl)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 7430-0008
3-(2-chlorophenyl)-8-[(2,6-dimethylmorpholin-4-yl)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one

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

7430-0008

Molecular Formula

C23H21ClF3NO4 (C23 H21 ClF3 NO4)

Compound Name

3-(2-chlorophenyl)-8-[(2,6-dimethylmorpholin-4-yl)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one

IUPAC name

3-(2-chlorophenyl)-8-[(26-dimethylmorpholin-4-yl)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one

SMILES

CC1OC(C)CN(Cc(c(OC(C(F)(F)F)=C2c(cccc3)c3Cl)c(cc3)C2=O)c3O)C1

InChI

InChI=1S/C23H21ClF3NO4/c1-12-9-28(10-13(2)31-12)11-16-18(29)8-7-15-20(30)19(14-5-3-4-6-17(14)24)22(23(25,26)27)32-21(15)16/h3-8,12-13,29H,9-11H2,1-2H3

InChI Key

SOQQJUCOCSPQGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02352574

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.399

Distribution Coefficient, logD

4.237

Water Solubility, LogSw

-4.19

Polar Surface Area

47.175

Acid Dissociation Constant (pKa)

7.78

Base Dissociation Constant (pKb)

5.80

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

34.80

7430-0008 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 7430-0008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7430-0008?
Check Price and Availability of 7430-0008, 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 7430-0008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7430-0008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7430-0008
  • 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 7430-0008 available by request