2732-4431 Screening compound: ethyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-(thiophene-2-amido)thiophene-3-carboxylate

2732-4431 Screening compound: ethyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-(thiophene-2-amido)thiophene-3-carboxylate
2732-4431 Screening compound: ethyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-(thiophene-2-amido)thiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2732-4431
ethyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-(thiophene-2-amido)thiophene-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

2732-4431

Molecular Formula

C21H20N2O5S2 (C21 H20 N2 O5 S2)

Compound Name

ethyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-(thiophene-2-amido)thiophene-3-carboxylate

IUPAC name

ethyl 5-[(4-methoxyphenyl)carbamoyl]-4-methyl-2-(thiophene-2-amido)thiophene-3-carboxylate

SMILES

CCOC(c1c(NC(c2cccs2)=O)sc(C(Nc(cc2)ccc2OC)=O)c1C)=O

InChI

InChI=1S/C21H20N2O5S2/c1-4-28-21(26)16-12(2)17(19(25)22-13-7-9-14(27-3)10-8-13)30-20(16)23-18(24)15-6-5-11-29-15/h5-11H,4H2,1-3H3,(H,22,25)(H,23,24)

InChI Key

UEVQNEBVPNUNGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01151545

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.145

Distribution Coefficient, logD

0.641

Water Solubility, LogSw

-4.25

Polar Surface Area

75.531

Acid Dissociation Constant (pKa)

3.90

Base Dissociation Constant (pKb)

1.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with 2732-4431 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2732-4431?
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What is the minimum amount of 2732-4431 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2732-4431
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2732-4431
  • 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 2732-4431 available by request