8010-4694 Screening compound: N-(3-methylphenyl)-N-[6-(4-methylpiperidino)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl]amine

8010-4694 Screening compound: N-(3-methylphenyl)-N-[6-(4-methylpiperidino)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl]amine
8010-4694 Screening compound: N-(3-methylphenyl)-N-[6-(4-methylpiperidino)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-4694
N-(3-methylphenyl)-N-[6-(4-methylpiperidino)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-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

8010-4694

Molecular Formula

C17H20N6O (C17 H20 N6 O)

Compound Name

N-(3-methylphenyl)-N-[6-(4-methylpiperidino)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl]amine

IUPAC name

N-(3-methylphenyl)-6-(4-methylpiperidin-1-yl)-[125]oxadiazolo[34-b]pyrazin-5-amine

SMILES

CC(CC1)CCN1c1nc2nonc2nc1Nc1cc(C)ccc1

InChI

InChI=1S/C17H20N6O/c1-11-6-8-23(9-7-11)17-16(18-13-5-3-4-12(2)10-13)19-14-15(20-17)22-24-21-14/h3-5,10-11H,6-9H2,1-2H3,(H,18,19,21)

InChI Key

PPKACDOWACCTBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01359806

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.914

Distribution Coefficient, logD

4.914

Water Solubility, LogSw

-4.63

Polar Surface Area

68.379

Acid Dissociation Constant (pKa)

14.98

Base Dissociation Constant (pKb)

6.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.18

References: we are preparing a list of scientific research reports with 8010-4694 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-4694?
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What is the minimum amount of 8010-4694 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-4694
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-4694
  • 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 8010-4694 available by request