F832-0544 Screening compound: N~1~-isobutyl-3-[9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]propanamide

F832-0544 Screening compound: N~1~-isobutyl-3-[9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]propanamide
F832-0544 Screening compound: N~1~-isobutyl-3-[9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F832-0544
N~1~-isobutyl-3-[9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]propanamide

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

F832-0544

Molecular Formula

C21H24N6O2 (C21 H24 N6 O2)

Compound Name

N~1~-isobutyl-3-[9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]propanamide

IUPAC name

3-[11-(4-methoxyphenyl)-346910-pentaazatricyclo[7.3.0.0^{26}]dodeca-1(12)24710-pentaen-5-yl]-N-(2-methylpropyl)propanamide

SMILES

CC(C)CNC(CCc1nnc(c2c3)n1ccn2nc3-c(cc1)ccc1OC)=O

InChI

InChI=1S/C21H24N6O2/c1-14(2)13-22-20(28)9-8-19-23-24-21-18-12-17(25-27(18)11-10-26(19)21)15-4-6-16(29-3)7-5-15/h4-7,10-12,14H,8-9,13H2,1-3H3,(H,22,28)

InChI Key

CCVNJSGKCQOIFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27197277

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.698

Distribution Coefficient, logD

1.631

Water Solubility, LogSw

-2.16

Polar Surface Area

65.989

Acid Dissociation Constant (pKa)

15.78

Base Dissociation Constant (pKb)

6.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

F832-0544 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F832-0544 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F832-0544?
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What is the minimum amount of F832-0544 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F832-0544
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F832-0544
  • 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 F832-0544 available by request