V022-1870 Screening compound: N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-fluoro-N-(3-methoxypropyl)benzamide

V022-1870 Screening compound: N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-fluoro-N-(3-methoxypropyl)benzamide
V022-1870 Screening compound: N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-fluoro-N-(3-methoxypropyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-1870
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-3-fluoro-N-(3-methoxypropyl)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

V022-1870

Molecular Formula

C28H30ClFN2O4S (C28 H30 ClFN2 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)-3-fluoro-N-(3-methoxypropyl)benzamide

IUPAC name

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

SMILES

Cc(cc(cc1)OCC(c2c(CC3)scc2)N3C(CN(CCCOC)C(c2cc(F)ccc2)=O)=O)c1Cl

InChI

InChI=1S/C28H30ClFN2O4S/c1-19-15-22(7-8-24(19)29)36-18-25-23-10-14-37-26(23)9-12-32(25)27(33)17-31(11-4-13-35-2)28(34)20-5-3-6-21(30)16-20/h3,5-8,10,14-16,25H,4,9,11-13,17-18H2,1-2H3/t25-/m0/s1

InChI Key

HLFUODNVVSPPLQ-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19865055

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

545.07

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

5.534

Distribution Coefficient, logD

5.534

Water Solubility, LogSw

-5.96

Polar Surface Area

48.607

Acid Dissociation Constant (pKa)

22.36

Base Dissociation Constant (pKb)

2.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V022-1870 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-1870
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-1870
  • 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 V022-1870 available by request