3534-0550 Screening compound: (E)-1-(2-chlorophenyl)-N-(1-ethyl-1H-1,3-benzodiazol-2-yl)methanimine

3534-0550 Screening compound: (E)-1-(2-chlorophenyl)-N-(1-ethyl-1H-1,3-benzodiazol-2-yl)methanimine
3534-0550 Screening compound: (E)-1-(2-chlorophenyl)-N-(1-ethyl-1H-1,3-benzodiazol-2-yl)methanimine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3534-0550
(E)-1-(2-chlorophenyl)-N-(1-ethyl-1H-1,3-benzodiazol-2-yl)methanimine

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

3534-0550

Molecular Formula

C16H14ClN3 (C16 H14 ClN3)

Compound Name

(E)-1-(2-chlorophenyl)-N-(1-ethyl-1H-1,3-benzodiazol-2-yl)methanimine

IUPAC name

(E)-1-(2-chlorophenyl)-N-(1-ethyl-1H-13-benzodiazol-2-yl)methanimine

SMILES

CCn1c(/N=C/c(cccc2)c2Cl)nc2c1cccc2

InChI

InChI=1S/C16H14ClN3/c1-2-20-15-10-6-5-9-14(15)19-16(20)18-11-12-7-3-4-8-13(12)17/h3-11H,2H2,1H3

InChI Key

YYUOXLJFKPXHEE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01136183

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.76

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.721

Distribution Coefficient, logD

4.721

Water Solubility, LogSw

-4.88

Polar Surface Area

20.198

Acid Dissociation Constant (pKa)

24.49

Base Dissociation Constant (pKb)

0.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

3534-0550 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3534-0550 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3534-0550?
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What is the minimum amount of 3534-0550 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3534-0550
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3534-0550
  • 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 3534-0550 available by request