G868-1284 Screening compound: 2-[4-(2,5-diethoxybenzenesulfonyl)piperazin-1-yl]-N,N,6-trimethylpyrimidin-4-amine

G868-1284 Screening compound: 2-[4-(2,5-diethoxybenzenesulfonyl)piperazin-1-yl]-N,N,6-trimethylpyrimidin-4-amine
G868-1284 Screening compound: 2-[4-(2,5-diethoxybenzenesulfonyl)piperazin-1-yl]-N,N,6-trimethylpyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound G868-1284
2-[4-(2,5-diethoxybenzenesulfonyl)piperazin-1-yl]-N,N,6-trimethylpyrimidin-4-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

G868-1284

Molecular Formula

C21H31N5O4S (C21 H31 N5 O4 S)

Compound Name

2-[4-(2,5-diethoxybenzenesulfonyl)piperazin-1-yl]-N,N,6-trimethylpyrimidin-4-amine

IUPAC name

2-[4-(25-diethoxybenzenesulfonyl)piperazin-1-yl]-NN6-trimethylpyrimidin-4-amine

SMILES

CCOc(cc1)cc(S(N(CC2)CCN2c2nc(N(C)C)cc(C)n2)(=O)=O)c1OCC

InChI

InChI=1S/C21H31N5O4S/c1-6-29-17-8-9-18(30-7-2)19(15-17)31(27,28)26-12-10-25(11-13-26)21-22-16(3)14-20(23-21)24(4)5/h8-9,14-15H,6-7,10-13H2,1-5H3

InChI Key

VBXVCJLTOAKOKE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09238151

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.675

Distribution Coefficient, logD

2.240

Water Solubility, LogSw

-3.73

Polar Surface Area

69.116

Acid Dissociation Constant (pKa)

20.87

Base Dissociation Constant (pKb)

8.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.40

G868-1284 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G868-1284 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G868-1284?
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What is the minimum amount of G868-1284 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G868-1284
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G868-1284
  • 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 G868-1284 available by request