V022-6649 Screening compound: 2-[1-(2-fluorophenyl)-N-[(oxolan-2-yl)methyl]formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide

V022-6649 Screening compound: 2-[1-(2-fluorophenyl)-N-[(oxolan-2-yl)methyl]formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide
V022-6649 Screening compound: 2-[1-(2-fluorophenyl)-N-[(oxolan-2-yl)methyl]formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-6649
2-[1-(2-fluorophenyl)-N-[(oxolan-2-yl)methyl]formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide

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

V022-6649

Molecular Formula

C27H28F2N2O3S (C27 H28 F2 N2 O3 S)

Compound Name

2-[1-(2-fluorophenyl)-N-[(oxolan-2-yl)methyl]formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide

IUPAC name

2-[1-(2-fluorophenyl)-N-[(oxolan-2-yl)methyl]formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide

SMILES

Cc1ccc(CN(Cc(cc2)ccc2F)C(CN(CC2OCCC2)C(c(cccc2)c2F)=O)=O)s1

InChI

InChI=1S/C27H28F2N2O3S/c1-19-8-13-23(35-19)17-30(15-20-9-11-21(28)12-10-20)26(32)18-31(16-22-5-4-14-34-22)27(33)24-6-2-3-7-25(24)29/h2-3,6-13,22H,4-5,14-18H2,1H3/t22-/m1/s1

InChI Key

ZZCWNDFHBMOKPU-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD19758632

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.59

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.158

Distribution Coefficient, logD

4.158

Water Solubility, LogSw

-4.26

Polar Surface Area

41.534

Acid Dissociation Constant (pKa)

21.62

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

V022-6649 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • PPI modulators
  • Epigenetic

References: we are preparing a list of scientific research reports with V022-6649 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-6649?
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What is the minimum amount of V022-6649 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-6649
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-6649
  • 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 V022-6649 available by request