T396-1611 Screening compound: N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]-3,5-difluorobenzamide

T396-1611 Screening compound: N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]-3,5-difluorobenzamide
T396-1611 Screening compound: N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]-3,5-difluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T396-1611
N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]-3,5-difluorobenzamide

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

T396-1611

Molecular Formula

C20H20F2N4O2 (C20 H20 F2 N4 O2)

Compound Name

N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]-3,5-difluorobenzamide

IUPAC name

N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]-35-difluorobenzamide

SMILES

O=C(c1cc(F)cc(F)c1)Nc(cc1)cnc1N(CCN1C2CCCC2)C1=O

InChI

InChI=1S/C20H20F2N4O2/c21-14-9-13(10-15(22)11-14)19(27)24-16-5-6-18(23-12-16)26-8-7-25(20(26)28)17-3-1-2-4-17/h5-6,9-12,17H,1-4,7-8H2,(H,24,27)

InChI Key

JRASSONTPQQYOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29024102

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.270

Distribution Coefficient, logD

4.252

Water Solubility, LogSw

-4.11

Polar Surface Area

51.608

Acid Dissociation Constant (pKa)

8.79

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

T396-1611 in Drug Discovery

Included in Screening Libraries

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

3D-Pharmacophore Based Diversity Library (49813 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with T396-1611 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T396-1611?
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What is the minimum amount of T396-1611 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T396-1611
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T396-1611
  • 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 T396-1611 available by request