V012-3468 Screening compound: 2-(4-fluorophenyl)-N-({[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-propylacetamide

V012-3468 Screening compound: 2-(4-fluorophenyl)-N-({[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-propylacetamide
V012-3468 Screening compound: 2-(4-fluorophenyl)-N-({[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-3468
2-(4-fluorophenyl)-N-({[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-propylacetamide

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

V012-3468

Molecular Formula

C26H28F2N2O2S (C26 H28 F2 N2 O2 S)

Compound Name

2-(4-fluorophenyl)-N-({[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-propylacetamide

IUPAC name

2-(4-fluorophenyl)-N-({[(4-fluorophenyl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-propylacetamide

SMILES

CCCN(CC(N(Cc1c(C)ccs1)Cc(cc1)ccc1F)=O)C(Cc(cc1)ccc1F)=O

InChI

InChI=1S/C26H28F2N2O2S/c1-3-13-29(25(31)15-20-4-8-22(27)9-5-20)18-26(32)30(17-24-19(2)12-14-33-24)16-21-6-10-23(28)11-7-21/h4-12,14H,3,13,15-18H2,1-2H3

InChI Key

ZQRVZURJFSOWKQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19762975

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.011

Distribution Coefficient, logD

5.011

Water Solubility, LogSw

-4.62

Polar Surface Area

32.602

Acid Dissociation Constant (pKa)

17.16

Base Dissociation Constant (pKb)

-2.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.77

References: we are preparing a list of scientific research reports with V012-3468 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-3468?
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What is the minimum amount of V012-3468 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-3468
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-3468
  • 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 V012-3468 available by request