T396-1044 Screening compound: N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]pyridine-3-carboxamide

T396-1044 Screening compound: N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]pyridine-3-carboxamide
T396-1044 Screening compound: N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T396-1044
N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]pyridine-3-carboxamide

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

T396-1044

Molecular Formula

C20H23N5O2 (C20 H23 N5 O2)

Compound Name

N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]pyridine-3-carboxamide

IUPAC name

N-[6-(3-cyclohexyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]pyridine-3-carboxamide

SMILES

O=C(c1cnccc1)Nc(cc1)cnc1N(CCN1C2CCCCC2)C1=O

InChI

InChI=1S/C20H23N5O2/c26-19(15-5-4-10-21-13-15)23-16-8-9-18(22-14-16)25-12-11-24(20(25)27)17-6-2-1-3-7-17/h4-5,8-10,13-14,17H,1-3,6-7,11-12H2,(H,23,26)

InChI Key

MUYUHKYQWVAYOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29023573

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.119

Distribution Coefficient, logD

3.119

Water Solubility, LogSw

-3.13

Polar Surface Area

60.760

Acid Dissociation Constant (pKa)

10.25

Base Dissociation Constant (pKb)

2.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

T396-1044 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with T396-1044 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T396-1044?
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What is the minimum amount of T396-1044 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T396-1044
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T396-1044
  • 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 T396-1044 available by request