D715-2194 Screening compound: N-{3-[(4-fluorophenyl)sulfonyl]-1-isobutyl-4,5-dimethyl-1H-pyrrol-2-yl}-1-cyclopropanecarboxamide

D715-2194 Screening compound: N-{3-[(4-fluorophenyl)sulfonyl]-1-isobutyl-4,5-dimethyl-1H-pyrrol-2-yl}-1-cyclopropanecarboxamide
D715-2194 Screening compound: N-{3-[(4-fluorophenyl)sulfonyl]-1-isobutyl-4,5-dimethyl-1H-pyrrol-2-yl}-1-cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D715-2194
N-{3-[(4-fluorophenyl)sulfonyl]-1-isobutyl-4,5-dimethyl-1H-pyrrol-2-yl}-1-cyclopropanecarboxamide

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

D715-2194

Molecular Formula

C20H25FN2O3S (C20 H25 FN2 O3 S)

Compound Name

N-{3-[(4-fluorophenyl)sulfonyl]-1-isobutyl-4,5-dimethyl-1H-pyrrol-2-yl}-1-cyclopropanecarboxamide

IUPAC name

N-[3-(4-fluorobenzenesulfonyl)-45-dimethyl-1-(2-methylpropyl)-1H-pyrrol-2-yl]cyclopropanecarboxamide

SMILES

CC(C)Cn(c(C)c1C)c(NC(C2CC2)=O)c1S(c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C20H25FN2O3S/c1-12(2)11-23-14(4)13(3)18(19(23)22-20(24)15-5-6-15)27(25,26)17-9-7-16(21)8-10-17/h7-10,12,15H,5-6,11H2,1-4H3,(H,22,24)

InChI Key

IBMHCBWZRWEKCJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12206823

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.126

Distribution Coefficient, logD

4.123

Water Solubility, LogSw

-4.10

Polar Surface Area

54.995

Acid Dissociation Constant (pKa)

9.54

Base Dissociation Constant (pKb)

-2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

D715-2194 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D715-2194 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D715-2194?
Check Price and Availability of D715-2194, 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 D715-2194 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D715-2194
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D715-2194
  • 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 D715-2194 available by request