V007-2820 Screening compound: 3-{[2-chloro-N-(2-methylpropyl)acetamido]methyl}phenyl 4-fluorobenzene-1-sulfonate

V007-2820 Screening compound: 3-{[2-chloro-N-(2-methylpropyl)acetamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
V007-2820 Screening compound: 3-{[2-chloro-N-(2-methylpropyl)acetamido]methyl}phenyl 4-fluorobenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-2820
3-{[2-chloro-N-(2-methylpropyl)acetamido]methyl}phenyl 4-fluorobenzene-1-sulfonate

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

V007-2820

Molecular Formula

C19H21ClFNO4S (C19 H21 ClFNO4 S)

Compound Name

3-{[2-chloro-N-(2-methylpropyl)acetamido]methyl}phenyl 4-fluorobenzene-1-sulfonate

IUPAC name

3-{[2-chloro-N-(2-methylpropyl)acetamido]methyl}phenyl 4-fluorobenzene-1-sulfonate

SMILES

CC(C)CN(Cc1cc(OS(c(cc2)ccc2F)(=O)=O)ccc1)C(CCl)=O

InChI

InChI=1S/C19H21ClFNO4S/c1-14(2)12-22(19(23)11-20)13-15-4-3-5-17(10-15)26-27(24,25)18-8-6-16(21)7-9-18/h3-10,14H,11-13H2,1-2H3

InChI Key

IDUUFHUAPJMUEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19742032

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.9

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.796

Distribution Coefficient, logD

3.796

Water Solubility, LogSw

-3.92

Polar Surface Area

51.955

Acid Dissociation Constant (pKa)

21.38

Base Dissociation Constant (pKb)

-2.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

V007-2820 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with V007-2820 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-2820?
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What is the minimum amount of V007-2820 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-2820
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-2820
  • 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 V007-2820 available by request