4223-7009 Screening compound: ethyl 2-(4-chloro-3-nitrobenzamido)-5-[(3-chloro-4-methylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

4223-7009 Screening compound: ethyl 2-(4-chloro-3-nitrobenzamido)-5-[(3-chloro-4-methylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate
4223-7009 Screening compound: ethyl 2-(4-chloro-3-nitrobenzamido)-5-[(3-chloro-4-methylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4223-7009
ethyl 2-(4-chloro-3-nitrobenzamido)-5-[(3-chloro-4-methylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

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

4223-7009

Molecular Formula

C23H19Cl2N3O6S (C23 H19 Cl2 N3 O6 S)

Compound Name

ethyl 2-(4-chloro-3-nitrobenzamido)-5-[(3-chloro-4-methylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

IUPAC name

ethyl 2-(4-chloro-3-nitrobenzamido)-5-[(3-chloro-4-methylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

SMILES

CCOC(c1c(NC(c(cc2)cc([N+]([O-])=O)c2Cl)=O)sc(C(Nc2cc(Cl)c(C)cc2)=O)c1C)=O

InChI

InChI=1S/C23H19Cl2N3O6S/c1-4-34-23(31)18-12(3)19(21(30)26-14-7-5-11(2)16(25)10-14)35-22(18)27-20(29)13-6-8-15(24)17(9-13)28(32)33/h5-10H,4H2,1-3H3,(H,26,30)(H,27,29)

InChI Key

YWFXMKBQUBQSJS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02627440

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

536.39

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.855

Distribution Coefficient, logD

-0.624

Water Solubility, LogSw

-6.30

Polar Surface Area

100.049

Acid Dissociation Constant (pKa)

0.92

Base Dissociation Constant (pKb)

-0.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with 4223-7009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4223-7009?
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What is the minimum amount of 4223-7009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4223-7009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4223-7009
  • 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 4223-7009 available by request