V028-1192 Screening compound: 2-[N-benzyl-1-(2-chlorophenyl)formamido]-N-{4-[4-(3-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide

V028-1192 Screening compound: 2-[N-benzyl-1-(2-chlorophenyl)formamido]-N-{4-[4-(3-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide
V028-1192 Screening compound: 2-[N-benzyl-1-(2-chlorophenyl)formamido]-N-{4-[4-(3-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-1192
2-[N-benzyl-1-(2-chlorophenyl)formamido]-N-{4-[4-(3-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide

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

V028-1192

Molecular Formula

C33H30ClFN4O3 (C33 H30 ClFN4 O3)

Compound Name

2-[N-benzyl-1-(2-chlorophenyl)formamido]-N-{4-[4-(3-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide

IUPAC name

2-[N-benzyl-1-(2-chlorophenyl)formamido]-N-{4-[4-(3-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide

SMILES

O=C(CN(Cc1ccccc1)C(c(cccc1)c1Cl)=O)Nc(cc1)ccc1N(CC1)CCN1C(c1cc(F)ccc1)=O

InChI

InChI=1S/C33H30ClFN4O3/c34-30-12-5-4-11-29(30)33(42)39(22-24-7-2-1-3-8-24)23-31(40)36-27-13-15-28(16-14-27)37-17-19-38(20-18-37)32(41)25-9-6-10-26(35)21-25/h1-16,21H,17-20,22-23H2,(H,36,40)

InChI Key

MUMMGGMGJLZXAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19815082

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

585.08

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

4.924

Distribution Coefficient, logD

4.924

Water Solubility, LogSw

-4.95

Polar Surface Area

59.236

Acid Dissociation Constant (pKa)

12.60

Base Dissociation Constant (pKb)

2.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

V028-1192 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 V028-1192 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-1192?
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What is the minimum amount of V028-1192 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-1192
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-1192
  • 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 V028-1192 available by request