G354-0656 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-fluorophenyl)-3-(1H-pyrrol-1-yl)propanamide

G354-0656 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-fluorophenyl)-3-(1H-pyrrol-1-yl)propanamide
G354-0656 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-fluorophenyl)-3-(1H-pyrrol-1-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G354-0656
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-fluorophenyl)-3-(1H-pyrrol-1-yl)propanamide

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

G354-0656

Molecular Formula

C21H19FN2O3 (C21 H19 FN2 O3)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-fluorophenyl)-3-(1H-pyrrol-1-yl)propanamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-3-(4-fluorophenyl)-3-(1H-pyrrol-1-yl)propanamide

SMILES

O=C(CC(c(cc1)ccc1F)n1cccc1)NCc(cc1)cc2c1OCO2

InChI

InChI=1S/C21H19FN2O3/c22-17-6-4-16(5-7-17)18(24-9-1-2-10-24)12-21(25)23-13-15-3-8-19-20(11-15)27-14-26-19/h1-11,18H,12-14H2,(H,23,25)/t18-/m0/s1

InChI Key

KNGAVDWSQXIPKJ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15001147

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.596

Distribution Coefficient, logD

3.596

Water Solubility, LogSw

-3.66

Polar Surface Area

45.077

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

-0.69

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

G354-0656 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G354-0656 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G354-0656?
Check Price and Availability of G354-0656, 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 G354-0656 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G354-0656
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G354-0656
  • 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 G354-0656 available by request