T396-0491 Screening compound: N-[6-(3-benzyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]cyclopentanecarboxamide

T396-0491 Screening compound: N-[6-(3-benzyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]cyclopentanecarboxamide
T396-0491 Screening compound: N-[6-(3-benzyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]cyclopentanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T396-0491
N-[6-(3-benzyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]cyclopentanecarboxamide

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

T396-0491

Molecular Formula

C21H24N4O2 (C21 H24 N4 O2)

Compound Name

N-[6-(3-benzyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]cyclopentanecarboxamide

IUPAC name

N-[6-(3-benzyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]cyclopentanecarboxamide

SMILES

O=C(C1CCCC1)Nc(cc1)cnc1N(CCN1Cc2ccccc2)C1=O

InChI

InChI=1S/C21H24N4O2/c26-20(17-8-4-5-9-17)23-18-10-11-19(22-14-18)25-13-12-24(21(25)27)15-16-6-2-1-3-7-16/h1-3,6-7,10-11,14,17H,4-5,8-9,12-13,15H2,(H,23,26)

InChI Key

DUZZHRSCIWWKLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29023843

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.540

Distribution Coefficient, logD

3.540

Water Solubility, LogSw

-3.29

Polar Surface Area

52.413

Acid Dissociation Constant (pKa)

11.45

Base Dissociation Constant (pKb)

3.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

T396-0491 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with T396-0491 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T396-0491?
Check Price and Availability of T396-0491, 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 T396-0491 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T396-0491
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T396-0491
  • 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 T396-0491 available by request