V008-5459 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylfuran-2-yl)methyl]carbamoyl}methyl)-N-[(oxolan-2-yl)methyl]nonanamide

V008-5459 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylfuran-2-yl)methyl]carbamoyl}methyl)-N-[(oxolan-2-yl)methyl]nonanamide
V008-5459 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylfuran-2-yl)methyl]carbamoyl}methyl)-N-[(oxolan-2-yl)methyl]nonanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-5459
N-({[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylfuran-2-yl)methyl]carbamoyl}methyl)-N-[(oxolan-2-yl)methyl]nonanamide

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

V008-5459

Molecular Formula

C30H42N2O6 (C30 H42 N2 O6)

Compound Name

N-({[(2H-1,3-benzodioxol-5-yl)methyl][(5-methylfuran-2-yl)methyl]carbamoyl}methyl)-N-[(oxolan-2-yl)methyl]nonanamide

IUPAC name

N-({[(2H-13-benzodioxol-5-yl)methyl][(5-methylfuran-2-yl)methyl]carbamoyl}methyl)-N-[(oxolan-2-yl)methyl]nonanamide

SMILES

CCCCCCCCC(N(CC1OCCC1)CC(N(Cc1ccc(C)o1)Cc(cc1)cc2c1OCO2)=O)=O

InChI

InChI=1S/C30H42N2O6/c1-3-4-5-6-7-8-11-29(33)32(19-25-10-9-16-35-25)21-30(34)31(20-26-14-12-23(2)38-26)18-24-13-15-27-28(17-24)37-22-36-27/h12-15,17,25H,3-11,16,18-22H2,1-2H3/t25-/m1/s1

InChI Key

SXHIUTWRIGEZBH-RUZDIDTESA-N

MDL Number (MFCD)

MFCD19742700

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

526.67

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

17.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.316

Distribution Coefficient, logD

5.316

Water Solubility, LogSw

-5.05

Polar Surface Area

64.638

Acid Dissociation Constant (pKa)

23.43

Base Dissociation Constant (pKb)

4.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

References: we are preparing a list of scientific research reports with V008-5459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-5459?
Check Price and Availability of V008-5459, 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 V008-5459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-5459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-5459
  • 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 V008-5459 available by request