G331-0221 Screening compound: 3-(3-ethoxypropyl)-1-({1-[(3-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)urea

G331-0221 Screening compound: 3-(3-ethoxypropyl)-1-({1-[(3-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)urea
G331-0221 Screening compound: 3-(3-ethoxypropyl)-1-({1-[(3-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G331-0221
3-(3-ethoxypropyl)-1-({1-[(3-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)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

G331-0221

Molecular Formula

C18H24FN3O2 (C18 H24 FN3 O2)

Compound Name

3-(3-ethoxypropyl)-1-({1-[(3-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)urea

IUPAC name

3-(3-ethoxypropyl)-1-({1-[(3-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)urea

SMILES

CCOCCCNC(NCc1cccn1Cc1cccc(F)c1)=O

InChI

InChI=1S/C18H24FN3O2/c1-2-24-11-5-9-20-18(23)21-13-17-8-4-10-22(17)14-15-6-3-7-16(19)12-15/h3-4,6-8,10,12H,2,5,9,11,13-14H2,1H3,(H2,20,21,23)

InChI Key

RSRGMOLMMXKBBT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14998210

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.418

Distribution Coefficient, logD

2.418

Water Solubility, LogSw

-2.80

Polar Surface Area

45.346

Acid Dissociation Constant (pKa)

14.25

Base Dissociation Constant (pKb)

-0.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

References: we are preparing a list of scientific research reports with G331-0221 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G331-0221?
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What is the minimum amount of G331-0221 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G331-0221
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G331-0221
  • 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 G331-0221 available by request