G545-1030 Screening compound: N-[(3-fluorophenyl)methyl]-3-({[(furan-2-yl)methyl]carbamoyl}amino)-4-(pyrrolidin-1-yl)benzamide

G545-1030 Screening compound: N-[(3-fluorophenyl)methyl]-3-({[(furan-2-yl)methyl]carbamoyl}amino)-4-(pyrrolidin-1-yl)benzamide
G545-1030 Screening compound: N-[(3-fluorophenyl)methyl]-3-({[(furan-2-yl)methyl]carbamoyl}amino)-4-(pyrrolidin-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G545-1030
N-[(3-fluorophenyl)methyl]-3-({[(furan-2-yl)methyl]carbamoyl}amino)-4-(pyrrolidin-1-yl)benzamide

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

G545-1030

Molecular Formula

C24H25FN4O3 (C24 H25 FN4 O3)

Compound Name

N-[(3-fluorophenyl)methyl]-3-({[(furan-2-yl)methyl]carbamoyl}amino)-4-(pyrrolidin-1-yl)benzamide

IUPAC name

N-[(3-fluorophenyl)methyl]-3-({[(furan-2-yl)methyl]carbamoyl}amino)-4-(pyrrolidin-1-yl)benzamide

SMILES

O=C(c(cc1)cc(NC(NCc2ccco2)=O)c1N1CCCC1)NCc1cccc(F)c1

InChI

InChI=1S/C24H25FN4O3/c25-19-6-3-5-17(13-19)15-26-23(30)18-8-9-22(29-10-1-2-11-29)21(14-18)28-24(31)27-16-20-7-4-12-32-20/h3-9,12-14H,1-2,10-11,15-16H2,(H,26,30)(H2,27,28,31)

InChI Key

KKQNEPHJPHOPCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15018944

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.123

Distribution Coefficient, logD

4.123

Water Solubility, LogSw

-4.28

Polar Surface Area

68.845

Acid Dissociation Constant (pKa)

10.67

Base Dissociation Constant (pKb)

1.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G545-1030 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with G545-1030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G545-1030?
Check Price and Availability of G545-1030, 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 G545-1030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G545-1030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G545-1030
  • 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 G545-1030 available by request