F831-1087 Screening compound: N~1~-(2-methoxyphenyl)-2-{[9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide

F831-1087 Screening compound: N~1~-(2-methoxyphenyl)-2-{[9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide
F831-1087 Screening compound: N~1~-(2-methoxyphenyl)-2-{[9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F831-1087
N~1~-(2-methoxyphenyl)-2-{[9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide

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

F831-1087

Molecular Formula

C23H20N6O3S (C23 H20 N6 O3 S)

Compound Name

N~1~-(2-methoxyphenyl)-2-{[9-(4-methoxyphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}acetamide

IUPAC name

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

SMILES

COc(cc1)ccc1-c1nn(ccn2c(SCC(Nc(cccc3)c3OC)=O)nnc22)c2c1

InChI

InChI=1S/C23H20N6O3S/c1-31-16-9-7-15(8-10-16)18-13-19-22-25-26-23(28(22)11-12-29(19)27-18)33-14-21(30)24-17-5-3-4-6-20(17)32-2/h3-13H,14H2,1-2H3,(H,24,30)

InChI Key

WGZKGTYNVBYZPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16637638

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.956

Distribution Coefficient, logD

2.911

Water Solubility, LogSw

-3.56

Polar Surface Area

70.934

Acid Dissociation Constant (pKa)

11.38

Base Dissociation Constant (pKb)

6.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

F831-1087 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with F831-1087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F831-1087?
Check Price and Availability of F831-1087, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F831-1087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F831-1087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F831-1087
  • 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 F831-1087 available by request