3843-0479 Screening compound: 4-{[3-(benzyldimethylazaniumyl)propyl]carbamoyl}-2-[(E)-(hydroxyimino)methyl]-1-methylpyridin-1-ium

3843-0479 Screening compound: 4-{[3-(benzyldimethylazaniumyl)propyl]carbamoyl}-2-[(E)-(hydroxyimino)methyl]-1-methylpyridin-1-ium
3843-0479 Screening compound: 4-{[3-(benzyldimethylazaniumyl)propyl]carbamoyl}-2-[(E)-(hydroxyimino)methyl]-1-methylpyridin-1-ium alternative view

Chemical Structure Depiction of ChemDiv screening compound 3843-0479
4-{[3-(benzyldimethylazaniumyl)propyl]carbamoyl}-2-[(E)-(hydroxyimino)methyl]-1-methylpyridin-1-ium

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

3843-0479

Molecular Formula

C20H28N4O2 (C20 H28 N4 O2)

Compound Name

4-{[3-(benzyldimethylazaniumyl)propyl]carbamoyl}-2-[(E)-(hydroxyimino)methyl]-1-methylpyridin-1-ium

IUPAC name

4-{[3-(benzyldimethylazaniumyl)propyl]carbamoyl}-2-[(E)-(hydroxyimino)methyl]-1-methylpyridin-1-ium

SMILES

C[N+](C)(CCCNC(c1cc(/C=N/O)[n+](C)cc1)=O)Cc1ccccc1

InChI

InChI=1S/C20H26N4O2/c1-23-12-10-18(14-19(23)15-22-26)20(25)21-11-7-13-24(2,3)16-17-8-5-4-6-9-17/h4-6,8-10,12,14-15H,7,11,13,16H2,1-3H3/p+2

InChI Key

QAIZYWSAILKJQP-UHFFFAOYSA-P

MDL Number (MFCD)

MFCD02928565

Chemical and Physical Properties

Saltdata

2I-

Molecular Weight

356.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.827

Distribution Coefficient, logD

1.827

Water Solubility, LogSw

-2.22

Polar Surface Area

55.723

Acid Dissociation Constant (pKa)

11.83

Base Dissociation Constant (pKb)

-1.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with 3843-0479 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3843-0479?
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What is the minimum amount of 3843-0479 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3843-0479
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3843-0479
  • 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 3843-0479 available by request