E983-1614 Screening compound: 3-{[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methyl}-1-(4-ethylphenyl)urea

E983-1614 Screening compound: 3-{[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methyl}-1-(4-ethylphenyl)urea
E983-1614 Screening compound: 3-{[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methyl}-1-(4-ethylphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E983-1614
3-{[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methyl}-1-(4-ethylphenyl)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

E983-1614

Molecular Formula

C23H27N3O (C23 H27 N3 O)

Compound Name

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

IUPAC name

3-{[25-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methyl}-1-(4-ethylphenyl)urea

SMILES

CCc(cc1)ccc1NC(NCc(cc1C)c(C)n1-c1cc(C)ccc1)=O

InChI

InChI=1S/C23H27N3O/c1-5-19-9-11-21(12-10-19)25-23(27)24-15-20-14-17(3)26(18(20)4)22-8-6-7-16(2)13-22/h6-14H,5,15H2,1-4H3,(H2,24,25,27)

InChI Key

CNKBGQSIDQDFQG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14935547

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.49

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

5.328

Distribution Coefficient, logD

5.328

Water Solubility, LogSw

-5.25

Polar Surface Area

36.528

Acid Dissociation Constant (pKa)

13.89

Base Dissociation Constant (pKb)

-0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with E983-1614 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E983-1614?
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What is the minimum amount of E983-1614 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E983-1614
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E983-1614
  • 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 E983-1614 available by request