E002-2552 Screening compound: N-{2-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-2-propylpentanamide

E002-2552 Screening compound: N-{2-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-2-propylpentanamide
E002-2552 Screening compound: N-{2-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-2-propylpentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E002-2552
N-{2-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-2-propylpentanamide

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

E002-2552

Molecular Formula

C28H35N3O4 (C28 H35 N3 O4)

Compound Name

N-{2-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-2-propylpentanamide

IUPAC name

N-{2-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-2-propylpentanamide

SMILES

CCCC(CCC)C(Nc1c(C(N(CC2)CCN2c2cc(OC)ccc2)=O)oc2c1cccc2)=O

InChI

InChI=1S/C28H35N3O4/c1-4-9-20(10-5-2)27(32)29-25-23-13-6-7-14-24(23)35-26(25)28(33)31-17-15-30(16-18-31)21-11-8-12-22(19-21)34-3/h6-8,11-14,19-20H,4-5,9-10,15-18H2,1-3H3,(H,29,32)

InChI Key

KNYWMRQYTOXZGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14835860

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.815

Distribution Coefficient, logD

5.725

Water Solubility, LogSw

-5.81

Polar Surface Area

58.184

Acid Dissociation Constant (pKa)

8.04

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with E002-2552 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E002-2552?
Check Price and Availability of E002-2552, 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 E002-2552 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E002-2552
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E002-2552
  • 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 E002-2552 available by request