D356-2107 Screening compound: 4-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}-1,2,3,4-tetrahydroquinoxalin-2-one

D356-2107 Screening compound: 4-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}-1,2,3,4-tetrahydroquinoxalin-2-one
D356-2107 Screening compound: 4-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}-1,2,3,4-tetrahydroquinoxalin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D356-2107
4-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}-1,2,3,4-tetrahydroquinoxalin-2-one

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

D356-2107

Molecular Formula

C21H22FN3O4S (C21 H22 FN3 O4 S)

Compound Name

4-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}-1,2,3,4-tetrahydroquinoxalin-2-one

IUPAC name

4-{1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carbonyl}-1234-tetrahydroquinoxalin-2-one

SMILES

O=C(C(CC1)CCN1S(Cc(cc1)ccc1F)(=O)=O)N(C1)c(cccc2)c2NC1=O

InChI

InChI=1S/C21H22FN3O4S/c22-17-7-5-15(6-8-17)14-30(28,29)24-11-9-16(10-12-24)21(27)25-13-20(26)23-18-3-1-2-4-19(18)25/h1-8,16H,9-14H2,(H,23,26)

InChI Key

MSYMDVQIOZUUKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14823982

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.731

Distribution Coefficient, logD

1.730

Water Solubility, LogSw

-2.51

Polar Surface Area

71.990

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

-1.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

D356-2107 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D356-2107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D356-2107?
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What is the minimum amount of D356-2107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D356-2107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D356-2107
  • 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 D356-2107 available by request