E983-1292 Screening compound: 3-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}-1-(2-methoxyphenyl)urea

E983-1292 Screening compound: 3-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}-1-(2-methoxyphenyl)urea
E983-1292 Screening compound: 3-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}-1-(2-methoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E983-1292
3-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}-1-(2-methoxyphenyl)urea

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

E983-1292

Molecular Formula

C21H22ClN3O2 (C21 H22 ClN3 O2)

Compound Name

3-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}-1-(2-methoxyphenyl)urea

IUPAC name

3-{[1-(4-chlorophenyl)-25-dimethyl-1H-pyrrol-3-yl]methyl}-1-(2-methoxyphenyl)urea

SMILES

Cc1cc(CNC(Nc(cccc2)c2OC)=O)c(C)n1-c(cc1)ccc1Cl

InChI

InChI=1S/C21H22ClN3O2/c1-14-12-16(15(2)25(14)18-10-8-17(22)9-11-18)13-23-21(26)24-19-6-4-5-7-20(19)27-3/h4-12H,13H2,1-3H3,(H2,23,24,26)

InChI Key

JWQYIPWXSMRIMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14935388

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.88

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.279

Distribution Coefficient, logD

4.279

Water Solubility, LogSw

-4.61

Polar Surface Area

43.461

Acid Dissociation Constant (pKa)

12.57

Base Dissociation Constant (pKb)

0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with E983-1292 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E983-1292?
Check Price and Availability of E983-1292, 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 E983-1292 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E983-1292
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E983-1292
  • 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 E983-1292 available by request