D470-2205 Screening compound: (3R,4S)-3-[(4-chlorophenyl)sulfonyl]-4-{[2-(2-thienyl)ethyl]amino}tetrahydro-1H-1lambda~6~-thiophene-1,1-dione

D470-2205 Screening compound: (3R,4S)-3-[(4-chlorophenyl)sulfonyl]-4-{[2-(2-thienyl)ethyl]amino}tetrahydro-1H-1lambda~6~-thiophene-1,1-dione
D470-2205 Screening compound: (3R,4S)-3-[(4-chlorophenyl)sulfonyl]-4-{[2-(2-thienyl)ethyl]amino}tetrahydro-1H-1lambda~6~-thiophene-1,1-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D470-2205
(3R,4S)-3-[(4-chlorophenyl)sulfonyl]-4-{[2-(2-thienyl)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

D470-2205

Molecular Formula

C16H18ClNO4S3 (C16 H18 ClNO4 S3)

Compound Name

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

IUPAC name

(3R4S)-3-(4-chlorobenzenesulfonyl)-4-{[2-(thiophen-2-yl)ethyl]amino}-1lambda6-thiolane-11-dione

SMILES

O=S([C@@H](CS(C1)(=O)=O)[C@H]1NCCc1cccs1)(c(cc1)ccc1Cl)=O

InChI

InChI=1S/C16H18ClNO4S3/c17-12-3-5-14(6-4-12)25(21,22)16-11-24(19,20)10-15(16)18-8-7-13-2-1-9-23-13/h1-6,9,15-16,18H,7-8,10-11H2/t15-,16-/m0/s1

InChI Key

UKMGVTDLLZMHEJ-HOTGVXAUSA-N

MDL Number (MFCD)

MFCD12922115

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.660

Distribution Coefficient, logD

1.660

Water Solubility, LogSw

-2.48

Polar Surface Area

70.708

Acid Dissociation Constant (pKa)

18.74

Base Dissociation Constant (pKb)

3.24

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with D470-2205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D470-2205?
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What is the minimum amount of D470-2205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D470-2205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D470-2205
  • 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 D470-2205 available by request