Y020-0638 Screening compound: N2-(3,4-dichlorophenyl)-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine

Y020-0638 Screening compound: N2-(3,4-dichlorophenyl)-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine
Y020-0638 Screening compound: N2-(3,4-dichlorophenyl)-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-0638
N2-(3,4-dichlorophenyl)-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine

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

Y020-0638

Molecular Formula

C21H23Cl2N7O (C21 H23 Cl2 N7 O)

Compound Name

N2-(3,4-dichlorophenyl)-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3,5-triazine-2,4-diamine

IUPAC name

N2-(34-dichlorophenyl)-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-135-triazine-24-diamine

SMILES

COc(cc1)ccc1N1CCN(Cc2nc(Nc(cc3)cc(Cl)c3Cl)nc(N)n2)CC1

InChI

InChI=1S/C21H23Cl2N7O/c1-31-16-5-3-15(4-6-16)30-10-8-29(9-11-30)13-19-26-20(24)28-21(27-19)25-14-2-7-17(22)18(23)12-14/h2-7,12H,8-11,13H2,1H3,(H3,24,25,26,27,28)

InChI Key

DDXNFKYLOKYKCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08546551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.780

Distribution Coefficient, logD

4.758

Water Solubility, LogSw

-4.80

Polar Surface Area

76.145

Acid Dissociation Constant (pKa)

13.88

Base Dissociation Constant (pKb)

6.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with Y020-0638 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-0638?
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What is the minimum amount of Y020-0638 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-0638
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-0638
  • 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 Y020-0638 available by request