E983-1608 Screening compound: 3-{[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methyl}-1-(2-methoxyphenyl)urea

E983-1608 Screening compound: 3-{[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methyl}-1-(2-methoxyphenyl)urea
E983-1608 Screening compound: 3-{[2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrol-3-yl]methyl}-1-(2-methoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E983-1608
3-{[2,5-dimethyl-1-(3-methylphenyl)-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

E983-1608

Molecular Formula

C22H25N3O2 (C22 H25 N3 O2)

Compound Name

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

IUPAC name

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

SMILES

Cc1cc(CNC(Nc(cccc2)c2OC)=O)c(C)n1-c1cc(C)ccc1

InChI

InChI=1S/C22H25N3O2/c1-15-8-7-9-19(12-15)25-16(2)13-18(17(25)3)14-23-22(26)24-20-10-5-6-11-21(20)27-4/h5-13H,14H2,1-4H3,(H2,23,24,26)

InChI Key

SYCSLNGRNUJEEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14935543

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.46

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

4.151

Distribution Coefficient, logD

4.151

Water Solubility, LogSw

-4.32

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

22.70

References: we are preparing a list of scientific research reports with E983-1608 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E983-1608?
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What is the minimum amount of E983-1608 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E983-1608
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E983-1608
  • 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 E983-1608 available by request