Y021-1428 Screening compound: N-{(Z)-1-(2,4-dichloroanilino)-1-[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene}-N'-(3,4-dichlorophenyl)urea

Y021-1428 Screening compound: N-{(Z)-1-(2,4-dichloroanilino)-1-[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene}-N'-(3,4-dichlorophenyl)urea
Y021-1428 Screening compound: N-{(Z)-1-(2,4-dichloroanilino)-1-[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene}-N'-(3,4-dichlorophenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-1428
N-{(Z)-1-(2,4-dichloroanilino)-1-[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene}-N'-(3,4-dichlorophenyl)urea

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

Y021-1428

Molecular Formula

C20H16Cl4N6O (C20 H16 Cl4 N6 O)

Compound Name

N-{(Z)-1-(2,4-dichloroanilino)-1-[(4,6-dimethyl-2-pyrimidinyl)amino]methylidene}-N'-(3,4-dichlorophenyl)urea

IUPAC name

1-(34-dichlorophenyl)-3-[(Z)-[(24-dichlorophenyl)amino][(46-dimethylpyrimidin-2-yl)amino]methylidene]urea

SMILES

Cc1nc(N/C(/Nc(ccc(Cl)c2)c2Cl)=N\C(Nc(cc2)cc(Cl)c2Cl)=O)nc(C)c1

InChI

InChI=1S/C20H16Cl4N6O/c1-10-7-11(2)26-18(25-10)29-19(28-17-6-3-12(21)8-16(17)24)30-20(31)27-13-4-5-14(22)15(23)9-13/h3-9H,1-2H3,(H3,25,26,27,28,29,30,31)

InChI Key

SQXQPWXBPDLXLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01796488

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.2

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.194

Distribution Coefficient, logD

2.550

Water Solubility, LogSw

-6.25

Polar Surface Area

68.361

Acid Dissociation Constant (pKa)

12.19

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with Y021-1428 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-1428?
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What is the minimum amount of Y021-1428 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-1428
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-1428
  • 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 Y021-1428 available by request