D470-1940 Screening compound: (3R,4S)-3-[(4-fluorophenyl)sulfonyl]-4-{methyl[2-(4-pyridyl)ethyl]amino}tetrahydro-1H-1lambda~6~-thiophene-1,1-dione

D470-1940 Screening compound: (3R,4S)-3-[(4-fluorophenyl)sulfonyl]-4-{methyl[2-(4-pyridyl)ethyl]amino}tetrahydro-1H-1lambda~6~-thiophene-1,1-dione
D470-1940 Screening compound: (3R,4S)-3-[(4-fluorophenyl)sulfonyl]-4-{methyl[2-(4-pyridyl)ethyl]amino}tetrahydro-1H-1lambda~6~-thiophene-1,1-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D470-1940
(3R,4S)-3-[(4-fluorophenyl)sulfonyl]-4-{methyl[2-(4-pyridyl)ethyl]amino}tetrahydro-1H-1lambda~6~-thiophene-1,1-dione

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

D470-1940

Molecular Formula

C18H21FN2O4S2 (C18 H21 FN2 O4 S2)

Compound Name

(3R,4S)-3-[(4-fluorophenyl)sulfonyl]-4-{methyl[2-(4-pyridyl)ethyl]amino}tetrahydro-1H-1lambda~6~-thiophene-1,1-dione

IUPAC name

(3R4S)-3-(4-fluorobenzenesulfonyl)-4-{methyl[2-(pyridin-4-yl)ethyl]amino}-1lambda6-thiolane-11-dione

SMILES

CN(CCc1ccncc1)[C@@H](CS(C1)(=O)=O)[C@H]1S(c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C18H21FN2O4S2/c1-21(11-8-14-6-9-20-10-7-14)17-12-26(22,23)13-18(17)27(24,25)16-4-2-15(19)3-5-16/h2-7,9-10,17-18H,8,11-13H2,1H3/t17-,18-/m1/s1

InChI Key

JBFXSTWTPPTSEA-QZTJIDSGSA-N

MDL Number (MFCD)

MFCD10089079

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.51

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.364

Distribution Coefficient, logD

0.348

Water Solubility, LogSw

-1.93

Polar Surface Area

69.836

Acid Dissociation Constant (pKa)

18.58

Base Dissociation Constant (pKb)

5.98

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

38.90

D470-1940 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D470-1940 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D470-1940?
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What is the minimum amount of D470-1940 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D470-1940
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D470-1940
  • 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 D470-1940 available by request