3254-2593 Screening compound: 4-[({4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl}imino)methyl]-2-methoxyphenol

3254-2593 Screening compound: 4-[({4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl}imino)methyl]-2-methoxyphenol
3254-2593 Screening compound: 4-[({4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl}imino)methyl]-2-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3254-2593
4-[({4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl}imino)methyl]-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

3254-2593

Molecular Formula

C21H27N3O2 (C21 H27 N3 O2)

Compound Name

4-[({4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl}imino)methyl]-2-methoxyphenol

IUPAC name

4-[({4-[(24-dimethylphenyl)methyl]piperazin-1-yl}imino)methyl]-2-methoxyphenol

SMILES

Cc1cc(C)c(CN(CC2)CCN2N=Cc(cc2)cc(OC)c2O)cc1

InChI

InChI=1S/C21H27N3O2/c1-16-4-6-19(17(2)12-16)15-23-8-10-24(11-9-23)22-14-18-5-7-20(25)21(13-18)26-3/h4-7,12-14,25H,8-11,15H2,1-3H3

InChI Key

OMYBLGUPUNQSCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02075260

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.46

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

3.497

Distribution Coefficient, logD

3.126

Water Solubility, LogSw

-2.97

Polar Surface Area

41.025

Acid Dissociation Constant (pKa)

9.56

Base Dissociation Constant (pKb)

7.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

3254-2593 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 3254-2593 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3254-2593?
Check Price and Availability of 3254-2593, 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 3254-2593 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3254-2593
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3254-2593
  • 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 3254-2593 available by request