V016-3294 Screening compound: N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)cyclopropanecarboxamide

V016-3294 Screening compound: N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)cyclopropanecarboxamide
V016-3294 Screening compound: N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-3294
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)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

V016-3294

Molecular Formula

C25H31ClN2O4S (C25 H31 ClN2 O4 S)

Compound Name

N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)cyclopropanecarboxamide

IUPAC name

N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-N-(3-methoxypropyl)cyclopropanecarboxamide

SMILES

Cc(cc(cc1)OCC(c2c(CC3)scc2)N3C(CN(CCCOC)C(C2CC2)=O)=O)c1Cl

InChI

InChI=1S/C25H31ClN2O4S/c1-17-14-19(6-7-21(17)26)32-16-22-20-9-13-33-23(20)8-11-28(22)24(29)15-27(10-3-12-31-2)25(30)18-4-5-18/h6-7,9,13-14,18,22H,3-5,8,10-12,15-16H2,1-2H3/t22-/m0/s1

InChI Key

ADFOARJLIWSFFD-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19865053

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.05

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.947

Distribution Coefficient, logD

4.947

Water Solubility, LogSw

-4.99

Polar Surface Area

49.130

Acid Dissociation Constant (pKa)

22.33

Base Dissociation Constant (pKb)

0.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.00

References: we are preparing a list of scientific research reports with V016-3294 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-3294?
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What is the minimum amount of V016-3294 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-3294
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-3294
  • 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 V016-3294 available by request