8013-6253 Screening compound: N2,N2-dimethyl-N4,N4-diphenyl-1,3,5-triazine-2,4,6-triamine

8013-6253 Screening compound: N2,N2-dimethyl-N4,N4-diphenyl-1,3,5-triazine-2,4,6-triamine
8013-6253 Screening compound: N2,N2-dimethyl-N4,N4-diphenyl-1,3,5-triazine-2,4,6-triamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-6253
N2,N2-dimethyl-N4,N4-diphenyl-1,3,5-triazine-2,4,6-triamine

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

8013-6253

Molecular Formula

C17H18N6 (C17 H18 N6)

Compound Name

N2,N2-dimethyl-N4,N4-diphenyl-1,3,5-triazine-2,4,6-triamine

IUPAC name

N2N2-dimethyl-N4N4-diphenyl-135-triazine-246-triamine

SMILES

CN(C)c1nc(N)nc(N(c2ccccc2)c2ccccc2)n1

InChI

InChI=1S/C17H18N6/c1-22(2)16-19-15(18)20-17(21-16)23(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3,(H2,18,19,20,21)

InChI Key

RXWHSQPUNDULPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03767111

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.581

Distribution Coefficient, logD

3.554

Water Solubility, LogSw

-3.64

Polar Surface Area

52.904

Acid Dissociation Constant (pKa)

19.00

Base Dissociation Constant (pKb)

6.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.76

8013-6253 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 8013-6253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-6253?
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What is the minimum amount of 8013-6253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-6253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-6253
  • 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 8013-6253 available by request