V028-2784 Screening compound: N-({2-[(4-fluorophenyl)methanesulfonyl]-1-[(oxolan-2-yl)methyl]-1H-imidazol-5-yl}methyl)-N-[(furan-2-yl)methyl]benzamide

V028-2784 Screening compound: N-({2-[(4-fluorophenyl)methanesulfonyl]-1-[(oxolan-2-yl)methyl]-1H-imidazol-5-yl}methyl)-N-[(furan-2-yl)methyl]benzamide
V028-2784 Screening compound: N-({2-[(4-fluorophenyl)methanesulfonyl]-1-[(oxolan-2-yl)methyl]-1H-imidazol-5-yl}methyl)-N-[(furan-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-2784
N-({2-[(4-fluorophenyl)methanesulfonyl]-1-[(oxolan-2-yl)methyl]-1H-imidazol-5-yl}methyl)-N-[(furan-2-yl)methyl]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

V028-2784

Molecular Formula

C28H28FN3O5S (C28 H28 FN3 O5 S)

Compound Name

N-({2-[(4-fluorophenyl)methanesulfonyl]-1-[(oxolan-2-yl)methyl]-1H-imidazol-5-yl}methyl)-N-[(furan-2-yl)methyl]benzamide

IUPAC name

N-({2-[(4-fluorophenyl)methanesulfonyl]-1-[(oxolan-2-yl)methyl]-1H-imidazol-5-yl}methyl)-N-[(furan-2-yl)methyl]benzamide

SMILES

O=C(c1ccccc1)N(Cc(n1CC2OCCC2)cnc1S(Cc(cc1)ccc1F)(=O)=O)Cc1ccco1

InChI

InChI=1S/C28H28FN3O5S/c29-23-12-10-21(11-13-23)20-38(34,35)28-30-16-24(32(28)19-26-9-5-15-37-26)17-31(18-25-8-4-14-36-25)27(33)22-6-2-1-3-7-22/h1-4,6-8,10-14,16,26H,5,9,15,17-20H2/t26-/m1/s1

InChI Key

JNMLJUHFTROCED-AREMUKBSSA-N

MDL Number (MFCD)

MFCD19815897

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

537.61

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.125

Distribution Coefficient, logD

3.125

Water Solubility, LogSw

-3.07

Polar Surface Area

72.994

Acid Dissociation Constant (pKa)

19.56

Base Dissociation Constant (pKb)

-3.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

V028-2784 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V028-2784 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-2784?
Check Price and Availability of V028-2784, 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 V028-2784 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-2784
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-2784
  • 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 V028-2784 available by request