C200-7642 Screening compound: ethyl (2E)-2-[(3-chloroquinoxalin-2-yl)sulfonyl]-3-(dimethylamino)prop-2-enoate

C200-7642 Screening compound: ethyl (2E)-2-[(3-chloroquinoxalin-2-yl)sulfonyl]-3-(dimethylamino)prop-2-enoate
C200-7642 Screening compound: ethyl (2E)-2-[(3-chloroquinoxalin-2-yl)sulfonyl]-3-(dimethylamino)prop-2-enoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-7642
ethyl (2E)-2-[(3-chloroquinoxalin-2-yl)sulfonyl]-3-(dimethylamino)prop-2-enoate

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

C200-7642

Molecular Formula

C15H16ClN3O4S (C15 H16 ClN3 O4 S)

Compound Name

ethyl (2E)-2-[(3-chloroquinoxalin-2-yl)sulfonyl]-3-(dimethylamino)prop-2-enoate

IUPAC name

ethyl (2E)-2-[(3-chloroquinoxalin-2-yl)sulfonyl]-3-(dimethylamino)prop-2-enoate

SMILES

CCOC(/C(/S(c1nc2ccccc2nc1Cl)(=O)=O)=C\N(C)C)=O

InChI

InChI=1S/C15H16ClN3O4S/c1-4-23-15(20)12(9-19(2)3)24(21,22)14-13(16)17-10-7-5-6-8-11(10)18-14/h5-9H,4H2,1-3H3

InChI Key

VTEDPPUCYHBUQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14728589

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.83

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.908

Distribution Coefficient, logD

1.908

Water Solubility, LogSw

-2.64

Polar Surface Area

73.378

Acid Dissociation Constant (pKa)

30.32

Base Dissociation Constant (pKb)

1.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

C200-7642 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C200-7642 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-7642?
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What is the minimum amount of C200-7642 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-7642
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-7642
  • 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 C200-7642 available by request