T396-1618 Screening compound: N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]-3,5-dimethoxybenzamide

T396-1618 Screening compound: N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]-3,5-dimethoxybenzamide
T396-1618 Screening compound: N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]-3,5-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T396-1618
N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)pyridin-3-yl]-3,5-dimethoxybenzamide

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

T396-1618

Molecular Formula

C22H26N4O4 (C22 H26 N4 O4)

Compound Name

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

IUPAC name

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

SMILES

COc1cc(C(Nc(cc2)cnc2N(CCN2C3CCCC3)C2=O)=O)cc(OC)c1

InChI

InChI=1S/C22H26N4O4/c1-29-18-11-15(12-19(13-18)30-2)21(27)24-16-7-8-20(23-14-16)26-10-9-25(22(26)28)17-5-3-4-6-17/h7-8,11-14,17H,3-6,9-10H2,1-2H3,(H,24,27)

InChI Key

AURCFJSRCBJSGH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29024108

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.999

Distribution Coefficient, logD

3.999

Water Solubility, LogSw

-4.06

Polar Surface Area

66.696

Acid Dissociation Constant (pKa)

11.80

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

T396-1618 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 T396-1618 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T396-1618?
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What is the minimum amount of T396-1618 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T396-1618
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T396-1618
  • 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 T396-1618 available by request