1731-1030 Screening compound: 4,6-bis[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N,N-diphenyl-1,3,5-triazin-2-amine

1731-1030 Screening compound: 4,6-bis[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N,N-diphenyl-1,3,5-triazin-2-amine
1731-1030 Screening compound: 4,6-bis[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N,N-diphenyl-1,3,5-triazin-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1731-1030
4,6-bis[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N,N-diphenyl-1,3,5-triazin-2-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

1731-1030

Molecular Formula

C27H24N8S2 (C27 H24 N8 S2)

Compound Name

4,6-bis[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N,N-diphenyl-1,3,5-triazin-2-amine

IUPAC name

46-bis[(46-dimethylpyrimidin-2-yl)sulfanyl]-NN-diphenyl-135-triazin-2-amine

SMILES

Cc1nc(Sc2nc(N(c3ccccc3)c3ccccc3)nc(Sc3nc(C)cc(C)n3)n2)nc(C)c1

InChI

InChI=1S/C27H24N8S2/c1-17-15-18(2)29-24(28-17)36-26-32-23(33-27(34-26)37-25-30-19(3)16-20(4)31-25)35(21-11-7-5-8-12-21)22-13-9-6-10-14-22/h5-16H,1-4H3

InChI Key

GTKMDOJYXIYDJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00574582

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

524.67

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.302

Distribution Coefficient, logD

5.002

Water Solubility, LogSw

-5.80

Polar Surface Area

61.420

Acid Dissociation Constant (pKa)

30.02

Base Dissociation Constant (pKb)

8.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

1731-1030 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 1731-1030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1731-1030?
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What is the minimum amount of 1731-1030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1731-1030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1731-1030
  • 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 1731-1030 available by request