V009-0994 Screening compound: 1-{[(5-methylfuran-2-yl)methyl][2-(morpholin-4-yl)ethyl]amino}-3-(2-methylphenoxy)propan-2-ol

V009-0994 Screening compound: 1-{[(5-methylfuran-2-yl)methyl][2-(morpholin-4-yl)ethyl]amino}-3-(2-methylphenoxy)propan-2-ol
V009-0994 Screening compound: 1-{[(5-methylfuran-2-yl)methyl][2-(morpholin-4-yl)ethyl]amino}-3-(2-methylphenoxy)propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-0994
1-{[(5-methylfuran-2-yl)methyl][2-(morpholin-4-yl)ethyl]amino}-3-(2-methylphenoxy)propan-2-ol

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

V009-0994

Molecular Formula

C22H32N2O4 (C22 H32 N2 O4)

Compound Name

1-{[(5-methylfuran-2-yl)methyl][2-(morpholin-4-yl)ethyl]amino}-3-(2-methylphenoxy)propan-2-ol

IUPAC name

1-{[(5-methylfuran-2-yl)methyl][2-(morpholin-4-yl)ethyl]amino}-3-(2-methylphenoxy)propan-2-ol

SMILES

Cc1ccc(CN(CCN2CCOCC2)CC(COc2c(C)cccc2)O)o1

InChI

InChI=1S/C22H32N2O4/c1-18-5-3-4-6-22(18)27-17-20(25)15-24(16-21-8-7-19(2)28-21)10-9-23-11-13-26-14-12-23/h3-8,20,25H,9-17H2,1-2H3/t20-/m0/s1

InChI Key

NQIPKAYEILWFQX-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19836991

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

388.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.023

Distribution Coefficient, logD

2.910

Water Solubility, LogSw

-2.95

Polar Surface Area

47.016

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

6.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.50

V009-0994 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V009-0994 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-0994?
Check Price and Availability of V009-0994, 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 V009-0994 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-0994
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-0994
  • 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 V009-0994 available by request