V002-4325 Screening compound: 2-[4-(3-bromobenzoyl)piperazin-1-yl]-N-(3-chlorophenyl)-2-cyclopentylacetamide

V002-4325 Screening compound: 2-[4-(3-bromobenzoyl)piperazin-1-yl]-N-(3-chlorophenyl)-2-cyclopentylacetamide
V002-4325 Screening compound: 2-[4-(3-bromobenzoyl)piperazin-1-yl]-N-(3-chlorophenyl)-2-cyclopentylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-4325
2-[4-(3-bromobenzoyl)piperazin-1-yl]-N-(3-chlorophenyl)-2-cyclopentylacetamide

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

V002-4325

Molecular Formula

C24H27BrClN3O2 (C24 H27 BrClN3 O2)

Compound Name

2-[4-(3-bromobenzoyl)piperazin-1-yl]-N-(3-chlorophenyl)-2-cyclopentylacetamide

IUPAC name

2-[4-(3-bromobenzoyl)piperazin-1-yl]-N-(3-chlorophenyl)-2-cyclopentylacetamide

SMILES

O=C(C(C1CCCC1)N(CC1)CCN1C(c1cccc(Br)c1)=O)Nc1cc(Cl)ccc1

InChI

InChI=1S/C24H27BrClN3O2/c25-19-8-3-7-18(15-19)24(31)29-13-11-28(12-14-29)22(17-5-1-2-6-17)23(30)27-21-10-4-9-20(26)16-21/h3-4,7-10,15-17,22H,1-2,5-6,11-14H2,(H,27,30)/t22-/m0/s1

InChI Key

YNSQCEQQUOEPLK-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19882978

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

504.85

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.839

Distribution Coefficient, logD

4.838

Water Solubility, LogSw

-4.92

Polar Surface Area

43.369

Acid Dissociation Constant (pKa)

10.06

Base Dissociation Constant (pKb)

2.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

V002-4325 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V002-4325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-4325?
Check Price and Availability of V002-4325, 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 V002-4325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-4325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-4325
  • 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 V002-4325 available by request