G500-0202 Screening compound: 4-tert-butyl-N-{2-[4-(dimethylamino)phenyl]-2-(pyrrolidin-1-yl)ethyl}benzamide

G500-0202 Screening compound: 4-tert-butyl-N-{2-[4-(dimethylamino)phenyl]-2-(pyrrolidin-1-yl)ethyl}benzamide
G500-0202 Screening compound: 4-tert-butyl-N-{2-[4-(dimethylamino)phenyl]-2-(pyrrolidin-1-yl)ethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G500-0202
4-tert-butyl-N-{2-[4-(dimethylamino)phenyl]-2-(pyrrolidin-1-yl)ethyl}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

G500-0202

Molecular Formula

C25H35N3O (C25 H35 N3 O)

Compound Name

4-tert-butyl-N-{2-[4-(dimethylamino)phenyl]-2-(pyrrolidin-1-yl)ethyl}benzamide

IUPAC name

4-tert-butyl-N-{2-[4-(dimethylamino)phenyl]-2-(pyrrolidin-1-yl)ethyl}benzamide

SMILES

CC(C)(C)c(cc1)ccc1C(NCC(c(cc1)ccc1N(C)C)N1CCCC1)=O

InChI

InChI=1S/C25H35N3O/c1-25(2,3)21-12-8-20(9-13-21)24(29)26-18-23(28-16-6-7-17-28)19-10-14-22(15-11-19)27(4)5/h8-15,23H,6-7,16-18H2,1-5H3,(H,26,29)/t23-/m0/s1

InChI Key

KHJFPIJEYBHQFD-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD08005011

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.57

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.841

Distribution Coefficient, logD

4.433

Water Solubility, LogSw

-4.46

Polar Surface Area

30.812

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

7.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

G500-0202 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with G500-0202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G500-0202?
Check Price and Availability of G500-0202, 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 G500-0202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G500-0202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G500-0202
  • 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 G500-0202 available by request