E649-1582 Screening compound: ethyl 4-acetamido-6-{[(4-ethylphenyl)carbamoyl]methyl}-2,3-dimethyl-6H-thieno[2,3-b]pyrrole-5-carboxylate

E649-1582 Screening compound: ethyl 4-acetamido-6-{[(4-ethylphenyl)carbamoyl]methyl}-2,3-dimethyl-6H-thieno[2,3-b]pyrrole-5-carboxylate
E649-1582 Screening compound: ethyl 4-acetamido-6-{[(4-ethylphenyl)carbamoyl]methyl}-2,3-dimethyl-6H-thieno[2,3-b]pyrrole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E649-1582
ethyl 4-acetamido-6-{[(4-ethylphenyl)carbamoyl]methyl}-2,3-dimethyl-6H-thieno[2,3-b]pyrrole-5-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

E649-1582

Molecular Formula

C23H27N3O4S (C23 H27 N3 O4 S)

Compound Name

ethyl 4-acetamido-6-{[(4-ethylphenyl)carbamoyl]methyl}-2,3-dimethyl-6H-thieno[2,3-b]pyrrole-5-carboxylate

IUPAC name

ethyl 4-acetamido-6-{[(4-ethylphenyl)carbamoyl]methyl}-23-dimethyl-6H-thieno[23-b]pyrrole-5-carboxylate

SMILES

CCc(cc1)ccc1NC(Cn1c(sc(C)c2C)c2c(NC(C)=O)c1C(OCC)=O)=O

InChI

InChI=1S/C23H27N3O4S/c1-6-16-8-10-17(11-9-16)25-18(28)12-26-21(23(29)30-7-2)20(24-15(5)27)19-13(3)14(4)31-22(19)26/h8-11H,6-7,12H2,1-5H3,(H,24,27)(H,25,28)

InChI Key

DGSNZKZRQFABTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14908746

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.886

Distribution Coefficient, logD

3.187

Water Solubility, LogSw

-4.01

Polar Surface Area

67.091

Acid Dissociation Constant (pKa)

6.80

Base Dissociation Constant (pKb)

0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with E649-1582 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E649-1582?
Check Price and Availability of E649-1582, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E649-1582 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E649-1582
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E649-1582
  • 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 E649-1582 available by request