V002-3392 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(3-methoxypropyl)hexanamide

V002-3392 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(3-methoxypropyl)hexanamide
V002-3392 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(3-methoxypropyl)hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-3392
N-({[(2H-1,3-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(3-methoxypropyl)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

V002-3392

Molecular Formula

C27H38N2O5S (C27 H38 N2 O5 S)

Compound Name

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

IUPAC name

N-({[(2H-13-benzodioxol-5-yl)methyl][(thiophen-2-yl)methyl]carbamoyl}methyl)-2-ethyl-N-(3-methoxypropyl)hexanamide

SMILES

CCCCC(CC)C(N(CCCOC)CC(N(Cc1cccs1)Cc(cc1)cc2c1OCO2)=O)=O

InChI

InChI=1S/C27H38N2O5S/c1-4-6-9-22(5-2)27(31)28(13-8-14-32-3)19-26(30)29(18-23-10-7-15-35-23)17-21-11-12-24-25(16-21)34-20-33-24/h7,10-12,15-16,22H,4-6,8-9,13-14,17-20H2,1-3H3/t22-/m0/s1

InChI Key

NVIAMDNZRITQME-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19749035

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

502.68

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

17.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.983

Distribution Coefficient, logD

4.983

Water Solubility, LogSw

-4.69

Polar Surface Area

58.859

Acid Dissociation Constant (pKa)

23.06

Base Dissociation Constant (pKb)

-0.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.60

References: we are preparing a list of scientific research reports with V002-3392 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-3392?
Check Price and Availability of V002-3392, 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 V002-3392 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-3392
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-3392
  • 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 V002-3392 available by request