C722-0625 Screening compound: ethyl 4-{[4-(dimethylamino)phenyl]carbamoyl}-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

C722-0625 Screening compound: ethyl 4-{[4-(dimethylamino)phenyl]carbamoyl}-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
C722-0625 Screening compound: ethyl 4-{[4-(dimethylamino)phenyl]carbamoyl}-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C722-0625
ethyl 4-{[4-(dimethylamino)phenyl]carbamoyl}-1-ethyl-3,5-dimethyl-1H-pyrrole-2-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

C722-0625

Molecular Formula

C20H27N3O3 (C20 H27 N3 O3)

Compound Name

ethyl 4-{[4-(dimethylamino)phenyl]carbamoyl}-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-{[4-(dimethylamino)phenyl]carbamoyl}-1-ethyl-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCn1c(C(OCC)=O)c(C)c(C(Nc(cc2)ccc2N(C)C)=O)c1C

InChI

InChI=1S/C20H27N3O3/c1-7-23-14(4)17(13(3)18(23)20(25)26-8-2)19(24)21-15-9-11-16(12-10-15)22(5)6/h9-12H,7-8H2,1-6H3,(H,21,24)

InChI Key

GJMWDMYMRHPCED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05898257

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.641

Distribution Coefficient, logD

3.632

Water Solubility, LogSw

-4.15

Polar Surface Area

47.611

Acid Dissociation Constant (pKa)

10.44

Base Dissociation Constant (pKb)

9.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

C722-0625 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C722-0625 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C722-0625?
Check Price and Availability of C722-0625, 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 C722-0625 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C722-0625
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C722-0625
  • 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 C722-0625 available by request