F506-0767 Screening compound: 6-{5-[3-(azepan-1-yl)-3-oxopropyl]-1,2,4-oxadiazol-3-yl}-4-methyl-2-(4-methylphenyl)-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione

F506-0767 Screening compound: 6-{5-[3-(azepan-1-yl)-3-oxopropyl]-1,2,4-oxadiazol-3-yl}-4-methyl-2-(4-methylphenyl)-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione
F506-0767 Screening compound: 6-{5-[3-(azepan-1-yl)-3-oxopropyl]-1,2,4-oxadiazol-3-yl}-4-methyl-2-(4-methylphenyl)-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound F506-0767
6-{5-[3-(azepan-1-yl)-3-oxopropyl]-1,2,4-oxadiazol-3-yl}-4-methyl-2-(4-methylphenyl)-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione

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

F506-0767

Molecular Formula

C22H26N6O4 (C22 H26 N6 O4)

Compound Name

6-{5-[3-(azepan-1-yl)-3-oxopropyl]-1,2,4-oxadiazol-3-yl}-4-methyl-2-(4-methylphenyl)-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione

IUPAC name

6-{5-[3-(azepan-1-yl)-3-oxopropyl]-124-oxadiazol-3-yl}-4-methyl-2-(4-methylphenyl)-2345-tetrahydro-124-triazine-35-dione

SMILES

Cc(cc1)ccc1N(C(N1C)=O)N=C(c2noc(CCC(N3CCCCCC3)=O)n2)C1=O

InChI

InChI=1S/C22H26N6O4/c1-15-7-9-16(10-8-15)28-22(31)26(2)21(30)19(24-28)20-23-17(32-25-20)11-12-18(29)27-13-5-3-4-6-14-27/h7-10H,3-6,11-14H2,1-2H3

InChI Key

QETDSBDBXJOXND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27134572

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.998

Distribution Coefficient, logD

2.998

Water Solubility, LogSw

-3.21

Polar Surface Area

90.077

Acid Dissociation Constant (pKa)

23.79

Base Dissociation Constant (pKb)

5.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

References: we are preparing a list of scientific research reports with F506-0767 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F506-0767?
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What is the minimum amount of F506-0767 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F506-0767
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F506-0767
  • 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 F506-0767 available by request