D340-1053 Screening compound: N5-benzyl-N4-[2-(dimethylamino)ethyl]-1H-imidazole-4,5-dicarboxamide

D340-1053 Screening compound: N5-benzyl-N4-[2-(dimethylamino)ethyl]-1H-imidazole-4,5-dicarboxamide
D340-1053 Screening compound: N5-benzyl-N4-[2-(dimethylamino)ethyl]-1H-imidazole-4,5-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D340-1053
N5-benzyl-N4-[2-(dimethylamino)ethyl]-1H-imidazole-4,5-dicarboxamide

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

D340-1053

Molecular Formula

C16H21N5O2 (C16 H21 N5 O2)

Compound Name

N5-benzyl-N4-[2-(dimethylamino)ethyl]-1H-imidazole-4,5-dicarboxamide

IUPAC name

N5-benzyl-N4-[2-(dimethylamino)ethyl]-1H-imidazole-45-dicarboxamide

SMILES

CN(C)CCNC(c1c(C(NCc2ccccc2)=O)[nH]cn1)=O

InChI

InChI=1S/C16H21N5O2/c1-21(2)9-8-17-15(22)13-14(20-11-19-13)16(23)18-10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,17,22)(H,18,23)(H,19,20)

InChI Key

MOOPDOONIXUZGB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14820588

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.204

Distribution Coefficient, logD

-0.937

Water Solubility, LogSw

-1.60

Polar Surface Area

75.413

Acid Dissociation Constant (pKa)

7.34

Base Dissociation Constant (pKb)

8.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

D340-1053 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D340-1053 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D340-1053?
Check Price and Availability of D340-1053, 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 D340-1053 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D340-1053
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D340-1053
  • 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 D340-1053 available by request