3254-0204 Screening compound: 4-[(1E)-1-({4-[(2-chlorophenyl)methyl]piperazin-1-yl}imino)ethyl]-2-methoxyphenol

3254-0204 Screening compound: 4-[(1E)-1-({4-[(2-chlorophenyl)methyl]piperazin-1-yl}imino)ethyl]-2-methoxyphenol
3254-0204 Screening compound: 4-[(1E)-1-({4-[(2-chlorophenyl)methyl]piperazin-1-yl}imino)ethyl]-2-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3254-0204
4-[(1E)-1-({4-[(2-chlorophenyl)methyl]piperazin-1-yl}imino)ethyl]-2-methoxyphenol

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

3254-0204

Molecular Formula

C20H24ClN3O2 (C20 H24 ClN3 O2)

Compound Name

4-[(1E)-1-({4-[(2-chlorophenyl)methyl]piperazin-1-yl}imino)ethyl]-2-methoxyphenol

IUPAC name

4-[(1E)-1-({4-[(2-chlorophenyl)methyl]piperazin-1-yl}imino)ethyl]-2-methoxyphenol

SMILES

C/C(/c(cc1)cc(OC)c1O)=N\N1CCN(Cc(cccc2)c2Cl)CC1

InChI

InChI=1S/C20H24ClN3O2/c1-15(16-7-8-19(25)20(13-16)26-2)22-24-11-9-23(10-12-24)14-17-5-3-4-6-18(17)21/h3-8,13,25H,9-12,14H2,1-2H3

InChI Key

NZUFXICBKOAXQH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02076440

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.88

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.660

Distribution Coefficient, logD

3.373

Water Solubility, LogSw

-3.77

Polar Surface Area

40.095

Acid Dissociation Constant (pKa)

9.98

Base Dissociation Constant (pKb)

7.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

3254-0204 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3254-0204 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3254-0204?
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What is the minimum amount of 3254-0204 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3254-0204
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3254-0204
  • 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 3254-0204 available by request