V028-5402 Screening compound: N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-(prop-2-en-1-yl)propanamide

V028-5402 Screening compound: N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-(prop-2-en-1-yl)propanamide
V028-5402 Screening compound: N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-(prop-2-en-1-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-5402
N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-(prop-2-en-1-yl)propanamide

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

V028-5402

Molecular Formula

C21H25FN2O2S (C21 H25 FN2 O2 S)

Compound Name

N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-(prop-2-en-1-yl)propanamide

IUPAC name

N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-(prop-2-en-1-yl)propanamide

SMILES

CCC(N(CC=C)CC(N(Cc1ccc(C)s1)Cc(cc1)ccc1F)=O)=O

InChI

InChI=1S/C21H25FN2O2S/c1-4-12-23(20(25)5-2)15-21(26)24(14-19-11-6-16(3)27-19)13-17-7-9-18(22)10-8-17/h4,6-11H,1,5,12-15H2,2-3H3

InChI Key

XMTGZWOSCIWIGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19758651

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.719

Distribution Coefficient, logD

3.719

Water Solubility, LogSw

-3.82

Polar Surface Area

32.874

Acid Dissociation Constant (pKa)

22.94

Base Dissociation Constant (pKb)

-1.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with V028-5402 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-5402?
Check Price and Availability of V028-5402, 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 V028-5402 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-5402
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-5402
  • 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 V028-5402 available by request