V025-5958 Screening compound: 2-{1-cyclobutyl-N-[(4-fluorophenyl)methyl]formamido}-N-{4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide

V025-5958 Screening compound: 2-{1-cyclobutyl-N-[(4-fluorophenyl)methyl]formamido}-N-{4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide
V025-5958 Screening compound: 2-{1-cyclobutyl-N-[(4-fluorophenyl)methyl]formamido}-N-{4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-5958
2-{1-cyclobutyl-N-[(4-fluorophenyl)methyl]formamido}-N-{4-[4-(2-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

V025-5958

Molecular Formula

C31H32F2N4O3 (C31 H32 F2 N4 O3)

Compound Name

2-{1-cyclobutyl-N-[(4-fluorophenyl)methyl]formamido}-N-{4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide

IUPAC name

2-{1-cyclobutyl-N-[(4-fluorophenyl)methyl]formamido}-N-{4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl}acetamide

SMILES

O=C(CN(Cc(cc1)ccc1F)C(C1CCC1)=O)Nc(cc1)ccc1N(CC1)CCN1C(c(cccc1)c1F)=O

InChI

InChI=1S/C31H32F2N4O3/c32-24-10-8-22(9-11-24)20-37(30(39)23-4-3-5-23)21-29(38)34-25-12-14-26(15-13-25)35-16-18-36(19-17-35)31(40)27-6-1-2-7-28(27)33/h1-2,6-15,23H,3-5,16-21H2,(H,34,38)

InChI Key

VPCUVFRKMYNHRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14256967

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

546.62

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

3.932

Distribution Coefficient, logD

3.932

Water Solubility, LogSw

-4.01

Polar Surface Area

59.759

Acid Dissociation Constant (pKa)

12.37

Base Dissociation Constant (pKb)

2.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.30

V025-5958 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

MCL1 Targeted Library (12200 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with V025-5958 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-5958?
Check Price and Availability of V025-5958, 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 V025-5958 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-5958
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-5958
  • 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 V025-5958 available by request