D470-2234 Screening compound: (3R,4S)-3-[(4-chlorophenyl)sulfonyl]-4-[4-(3-methylphenyl)piperazino]tetrahydro-1H-1lambda~6~-thiophene-1,1-dione

D470-2234 Screening compound: (3R,4S)-3-[(4-chlorophenyl)sulfonyl]-4-[4-(3-methylphenyl)piperazino]tetrahydro-1H-1lambda~6~-thiophene-1,1-dione
D470-2234 Screening compound: (3R,4S)-3-[(4-chlorophenyl)sulfonyl]-4-[4-(3-methylphenyl)piperazino]tetrahydro-1H-1lambda~6~-thiophene-1,1-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D470-2234
(3R,4S)-3-[(4-chlorophenyl)sulfonyl]-4-[4-(3-methylphenyl)piperazino]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

D470-2234

Molecular Formula

C21H25ClN2O4S2 (C21 H25 ClN2 O4 S2)

Compound Name

(3R,4S)-3-[(4-chlorophenyl)sulfonyl]-4-[4-(3-methylphenyl)piperazino]tetrahydro-1H-1lambda~6~-thiophene-1,1-dione

IUPAC name

(3R4S)-3-(4-chlorobenzenesulfonyl)-4-[4-(3-methylphenyl)piperazin-1-yl]-1lambda6-thiolane-11-dione

SMILES

Cc1cccc(N(CC2)CCN2[C@@H](CS(C2)(=O)=O)[C@H]2S(c(cc2)ccc2Cl)(=O)=O)c1

InChI

InChI=1S/C21H25ClN2O4S2/c1-16-3-2-4-18(13-16)23-9-11-24(12-10-23)20-14-29(25,26)15-21(20)30(27,28)19-7-5-17(22)6-8-19/h2-8,13,20-21H,9-12,14-15H2,1H3/t20-,21-/m0/s1

InChI Key

WPDHLFJINYEXGF-SFTDATJTSA-N

MDL Number (MFCD)

MFCD10043051

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.03

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.752

Distribution Coefficient, logD

2.752

Water Solubility, LogSw

-3.34

Polar Surface Area

64.188

Acid Dissociation Constant (pKa)

18.89

Base Dissociation Constant (pKb)

2.93

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with D470-2234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D470-2234?
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What is the minimum amount of D470-2234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D470-2234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D470-2234
  • 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 D470-2234 available by request