3456-4144 Screening compound: N-[(Z)-[(4,6-dimethylpyrimidin-2-yl)amino][(4-ethoxyphenyl)amino]methylidene]benzamide

3456-4144 Screening compound: N-[(Z)-[(4,6-dimethylpyrimidin-2-yl)amino][(4-ethoxyphenyl)amino]methylidene]benzamide
3456-4144 Screening compound: N-[(Z)-[(4,6-dimethylpyrimidin-2-yl)amino][(4-ethoxyphenyl)amino]methylidene]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3456-4144
N-[(Z)-[(4,6-dimethylpyrimidin-2-yl)amino][(4-ethoxyphenyl)amino]methylidene]benzamide

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

3456-4144

Molecular Formula

C22H23N5O2 (C22 H23 N5 O2)

Compound Name

N-[(Z)-[(4,6-dimethylpyrimidin-2-yl)amino][(4-ethoxyphenyl)amino]methylidene]benzamide

IUPAC name

N-[(Z)-[(46-dimethylpyrimidin-2-yl)amino][(4-ethoxyphenyl)amino]methylidene]benzamide

SMILES

CCOc(cc1)ccc1N/C(/Nc1nc(C)cc(C)n1)=N/C(c1ccccc1)=O

InChI

InChI=1S/C22H23N5O2/c1-4-29-19-12-10-18(11-13-19)25-22(26-20(28)17-8-6-5-7-9-17)27-21-23-15(2)14-16(3)24-21/h5-14H,4H2,1-3H3,(H2,23,24,25,26,27,28)

InChI Key

IVCPKGJEDMRSKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01796462

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.850

Distribution Coefficient, logD

2.669

Water Solubility, LogSw

-3.90

Polar Surface Area

66.971

Acid Dissociation Constant (pKa)

10.76

Base Dissociation Constant (pKb)

8.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with 3456-4144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3456-4144?
Check Price and Availability of 3456-4144, 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 3456-4144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3456-4144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3456-4144
  • 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 3456-4144 available by request