V028-7562 Screening compound: 2,4-difluoro-N-{6-[4-(furan-2-carbonyl)piperazin-1-yl]pyridin-3-yl}benzamide

V028-7562 Screening compound: 2,4-difluoro-N-{6-[4-(furan-2-carbonyl)piperazin-1-yl]pyridin-3-yl}benzamide
V028-7562 Screening compound: 2,4-difluoro-N-{6-[4-(furan-2-carbonyl)piperazin-1-yl]pyridin-3-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-7562
2,4-difluoro-N-{6-[4-(furan-2-carbonyl)piperazin-1-yl]pyridin-3-yl}benzamide

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

V028-7562

Molecular Formula

C21H18F2N4O3 (C21 H18 F2 N4 O3)

Compound Name

2,4-difluoro-N-{6-[4-(furan-2-carbonyl)piperazin-1-yl]pyridin-3-yl}benzamide

IUPAC name

24-difluoro-N-{6-[4-(furan-2-carbonyl)piperazin-1-yl]pyridin-3-yl}benzamide

SMILES

O=C(c1ccco1)N(CC1)CCN1c(cc1)ncc1NC(c(ccc(F)c1)c1F)=O

InChI

InChI=1S/C21H18F2N4O3/c22-14-3-5-16(17(23)12-14)20(28)25-15-4-6-19(24-13-15)26-7-9-27(10-8-26)21(29)18-2-1-11-30-18/h1-6,11-13H,7-10H2,(H,25,28)

InChI Key

MNPOVMNTYSEUNW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19898462

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

412.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.392

Distribution Coefficient, logD

3.372

Water Solubility, LogSw

-3.62

Polar Surface Area

60.418

Acid Dissociation Constant (pKa)

8.74

Base Dissociation Constant (pKb)

4.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

V028-7562 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V028-7562 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-7562?
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What is the minimum amount of V028-7562 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-7562
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-7562
  • 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 V028-7562 available by request