V016-3047 Screening compound: N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)cyclopropanecarboxamide

V016-3047 Screening compound: N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)cyclopropanecarboxamide
V016-3047 Screening compound: N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-3047
N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)cyclopropanecarboxamide

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

V016-3047

Molecular Formula

C23H25FN2O3S (C23 H25 FN2 O3 S)

Compound Name

N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)cyclopropanecarboxamide

IUPAC name

N-(2-{4-[(4-fluorophenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)cyclopropanecarboxamide

SMILES

C=CCN(CC(N(CC1)C(COc(cc2)ccc2F)c2c1scc2)=O)C(C1CC1)=O

InChI

InChI=1S/C23H25FN2O3S/c1-2-11-25(23(28)16-3-4-16)14-22(27)26-12-9-21-19(10-13-30-21)20(26)15-29-18-7-5-17(24)6-8-18/h2,5-8,10,13,16,20H,1,3-4,9,11-12,14-15H2/t20-/m0/s1

InChI Key

LLOIYYDHKRIXJX-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19867142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.957

Distribution Coefficient, logD

3.957

Water Solubility, LogSw

-4.05

Polar Surface Area

40.788

Acid Dissociation Constant (pKa)

21.75

Base Dissociation Constant (pKb)

0.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with V016-3047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-3047?
Check Price and Availability of V016-3047, 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 V016-3047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-3047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-3047
  • 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 V016-3047 available by request