E983-1357 Screening compound: 1-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}-3-propylurea

E983-1357 Screening compound: 1-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}-3-propylurea
E983-1357 Screening compound: 1-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}-3-propylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound E983-1357
1-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}-3-propylurea

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

E983-1357

Molecular Formula

C17H22ClN3O (C17 H22 ClN3 O)

Compound Name

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

IUPAC name

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

SMILES

CCCNC(NCc(cc1C)c(C)n1-c(cc1)ccc1Cl)=O

InChI

InChI=1S/C17H22ClN3O/c1-4-9-19-17(22)20-11-14-10-12(2)21(13(14)3)16-7-5-15(18)6-8-16/h5-8,10H,4,9,11H2,1-3H3,(H2,19,20,22)

InChI Key

ZMVVYPICNRYKSE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14935426

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.83

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.241

Distribution Coefficient, logD

3.241

Water Solubility, LogSw

-3.59

Polar Surface Area

37.964

Acid Dissociation Constant (pKa)

14.14

Base Dissociation Constant (pKb)

0.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

References: we are preparing a list of scientific research reports with E983-1357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E983-1357?
Check Price and Availability of E983-1357, 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 E983-1357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E983-1357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E983-1357
  • 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 E983-1357 available by request