Y021-3144 Screening compound: N-[4-AMINO-6-(CHLOROMETHYL)-1,3,5-TRIAZIN-2-YL]-N-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)AMINE

Y021-3144 Screening compound: N-[4-AMINO-6-(CHLOROMETHYL)-1,3,5-TRIAZIN-2-YL]-N-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)AMINE
Y021-3144 Screening compound: N-[4-AMINO-6-(CHLOROMETHYL)-1,3,5-TRIAZIN-2-YL]-N-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-3144
N-[4-AMINO-6-(CHLOROMETHYL)-1,3,5-TRIAZIN-2-YL]-N-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)AMINE

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

Y021-3144

Molecular Formula

C12H12ClN5O2 (C12 H12 ClN5 O2)

Compound Name

N-[4-AMINO-6-(CHLOROMETHYL)-1,3,5-TRIAZIN-2-YL]-N-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)AMINE

IUPAC name

n/a

SMILES

Nc1nc(CCl)nc(Nc(cc2)cc3c2OCCO3)n1

InChI

InChI=1S/C12H12ClN5O2/c13-6-10-16-11(14)18-12(17-10)15-7-1-2-8-9(5-7)20-4-3-19-8/h1-2,5H,3-4,6H2,(H3,14,15,16,17,18)

InChI Key

QGSHRVYOIASLMD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.71

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.407

Distribution Coefficient, logD

1.406

Water Solubility, LogSw

-2.01

Polar Surface Area

77.431

Acid Dissociation Constant (pKa)

15.74

Base Dissociation Constant (pKb)

4.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with Y021-3144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-3144?
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What is the minimum amount of Y021-3144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-3144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-3144
  • 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 Y021-3144 available by request