T396-0435 Screening compound: N-[6-(3-benzyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]cyclobutanecarboxamide

T396-0435 Screening compound: N-[6-(3-benzyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]cyclobutanecarboxamide
T396-0435 Screening compound: N-[6-(3-benzyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T396-0435
N-[6-(3-benzyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]cyclobutanecarboxamide

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

T396-0435

Molecular Formula

C20H22N4O2 (C20 H22 N4 O2)

Compound Name

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

IUPAC name

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

SMILES

O=C(C1CCC1)Nc(cc1)cnc1N(CCN1Cc2ccccc2)C1=O

InChI

InChI=1S/C20H22N4O2/c25-19(16-7-4-8-16)22-17-9-10-18(21-13-17)24-12-11-23(20(24)26)14-15-5-2-1-3-6-15/h1-3,5-6,9-10,13,16H,4,7-8,11-12,14H2,(H,22,25)

InChI Key

MQEQJFAODBAATH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29023499

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.42

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

2.404

Distribution Coefficient, logD

2.403

Water Solubility, LogSw

-2.68

Polar Surface Area

52.378

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

3.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

T396-0435 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • 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 T396-0435 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T396-0435?
Check Price and Availability of T396-0435, 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 T396-0435 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T396-0435
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T396-0435
  • 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 T396-0435 available by request