V009-4221 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(furan-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(2-methylpropyl)hexanamide

V009-4221 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(furan-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(2-methylpropyl)hexanamide
V009-4221 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(furan-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(2-methylpropyl)hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-4221
N-({[(2H-1,3-benzodioxol-5-yl)methyl][(furan-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(2-methylpropyl)hexanamide

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

V009-4221

Molecular Formula

C27H38N2O5 (C27 H38 N2 O5)

Compound Name

N-({[(2H-1,3-benzodioxol-5-yl)methyl][(furan-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(2-methylpropyl)hexanamide

IUPAC name

N-({[(2H-13-benzodioxol-5-yl)methyl][(furan-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(2-methylpropyl)hexanamide

SMILES

CCCCC(CC)C(N(CC(C)C)CC(N(Cc1ccco1)Cc(cc1)cc2c1OCO2)=O)=O

InChI

InChI=1S/C27H38N2O5/c1-5-7-9-22(6-2)27(31)29(15-20(3)4)18-26(30)28(17-23-10-8-13-32-23)16-21-11-12-24-25(14-21)34-19-33-24/h8,10-14,20,22H,5-7,9,15-19H2,1-4H3/t22-/m0/s1

InChI Key

QNJWZQNMICFDQJ-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19740047

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.507

Distribution Coefficient, logD

5.507

Water Solubility, LogSw

-5.34

Polar Surface Area

57.269

Acid Dissociation Constant (pKa)

23.06

Base Dissociation Constant (pKb)

-1.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.60

References: we are preparing a list of scientific research reports with V009-4221 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-4221?
Check Price and Availability of V009-4221, 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 V009-4221 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-4221
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-4221
  • 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 V009-4221 available by request