4255-0034 Screening compound: 2-ethyl 4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

4255-0034 Screening compound: 2-ethyl 4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
4255-0034 Screening compound: 2-ethyl 4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4255-0034
2-ethyl 4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

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

4255-0034

Molecular Formula

C11H15NO4 (C11 H15 NO4)

Compound Name

2-ethyl 4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

IUPAC name

2-ethyl 4-methyl 35-dimethyl-1H-pyrrole-24-dicarboxylate

SMILES

CCOC(c1c(C)c(C(OC)=O)c(C)[nH]1)=O

InChI

InChI=1S/C11H15NO4/c1-5-16-11(14)9-6(2)8(7(3)12-9)10(13)15-4/h12H,5H2,1-4H3

InChI Key

ZMFJOSFCIPKJCH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00450313

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

225.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.831

Distribution Coefficient, logD

1.831

Water Solubility, LogSw

-1.53

Polar Surface Area

53.147

Acid Dissociation Constant (pKa)

6.77

Base Dissociation Constant (pKb)

-4.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

4255-0034 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 4255-0034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4255-0034?
Check Price and Availability of 4255-0034, 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 4255-0034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4255-0034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4255-0034
  • 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 4255-0034 available by request