E983-1389 Screening compound: ethyl 2-[({[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamoyl)amino]benzoate

E983-1389 Screening compound: ethyl 2-[({[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamoyl)amino]benzoate
E983-1389 Screening compound: ethyl 2-[({[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamoyl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound E983-1389
ethyl 2-[({[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamoyl)amino]benzoate

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

E983-1389

Molecular Formula

C24H27N3O4 (C24 H27 N3 O4)

Compound Name

ethyl 2-[({[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamoyl)amino]benzoate

IUPAC name

ethyl 2-[({[1-(4-methoxyphenyl)-25-dimethyl-1H-pyrrol-3-yl]methyl}carbamoyl)amino]benzoate

SMILES

CCOC(c(cccc1)c1NC(NCc(cc1C)c(C)n1-c(cc1)ccc1OC)=O)=O

InChI

InChI=1S/C24H27N3O4/c1-5-31-23(28)21-8-6-7-9-22(21)26-24(29)25-15-18-14-16(2)27(17(18)3)19-10-12-20(30-4)13-11-19/h6-14H,5,15H2,1-4H3,(H2,25,26,29)

InChI Key

GCIDCCQHFIXYIW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14935451

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.181

Distribution Coefficient, logD

4.180

Water Solubility, LogSw

-4.26

Polar Surface Area

64.128

Acid Dissociation Constant (pKa)

10.11

Base Dissociation Constant (pKb)

-1.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

E983-1389 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with E983-1389 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E983-1389?
Check Price and Availability of E983-1389, 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 E983-1389 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E983-1389
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E983-1389
  • 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 E983-1389 available by request