V030-0485 Screening compound: 4-[4-(2,4-DIMETHOXYPHENYL)-1-(FURAN-2-CARBONYL)PYRROLIDINE-3-CARBONYL]MORPHOLINE

V030-0485 Screening compound: 4-[4-(2,4-DIMETHOXYPHENYL)-1-(FURAN-2-CARBONYL)PYRROLIDINE-3-CARBONYL]MORPHOLINE
V030-0485 Screening compound: 4-[4-(2,4-DIMETHOXYPHENYL)-1-(FURAN-2-CARBONYL)PYRROLIDINE-3-CARBONYL]MORPHOLINE alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-0485
4-[4-(2,4-DIMETHOXYPHENYL)-1-(FURAN-2-CARBONYL)PYRROLIDINE-3-CARBONYL]MORPHOLINE

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

V030-0485

Molecular Formula

C22H26N2O6 (C22 H26 N2 O6)

Compound Name

4-[4-(2,4-DIMETHOXYPHENYL)-1-(FURAN-2-CARBONYL)PYRROLIDINE-3-CARBONYL]MORPHOLINE

IUPAC name

n/a

SMILES

COc1cc(OC)c(C(CN(C2)C(c3ccco3)=O)C2C(N2CCOCC2)=O)cc1

InChI

InChI=1S/C22H26N2O6/c1-27-15-5-6-16(20(12-15)28-2)17-13-24(22(26)19-4-3-9-30-19)14-18(17)21(25)23-7-10-29-11-8-23/h3-6,9,12,17-18H,7-8,10-11,13-14H2,1-2H3

InChI Key

LQCDROXFRKMKNU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14262471

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.653

Distribution Coefficient, logD

1.653

Water Solubility, LogSw

-2.26

Polar Surface Area

65.157

Acid Dissociation Constant (pKa)

21.17

Base Dissociation Constant (pKb)

-0.70

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

45.50

V030-0485 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Anti-HIV1 Library (19540 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Antiviral
  • Infections
  • Immune system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V030-0485 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-0485?
Check Price and Availability of V030-0485, 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 V030-0485 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-0485
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-0485
  • 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 V030-0485 available by request