P590-0875 Screening compound: N~1~-(4-methoxybenzyl)-2-[4-oxo-2-(2-thienyl)pyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]acetamide

P590-0875 Screening compound: N~1~-(4-methoxybenzyl)-2-[4-oxo-2-(2-thienyl)pyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]acetamide
P590-0875 Screening compound: N~1~-(4-methoxybenzyl)-2-[4-oxo-2-(2-thienyl)pyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P590-0875
N~1~-(4-methoxybenzyl)-2-[4-oxo-2-(2-thienyl)pyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]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

P590-0875

Molecular Formula

C23H19N5O3S (C23 H19 N5 O3 S)

Compound Name

N~1~-(4-methoxybenzyl)-2-[4-oxo-2-(2-thienyl)pyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]acetamide

IUPAC name

N-[(4-methoxyphenyl)methyl]-2-[7-oxo-4-(thiophen-2-yl)-23813-tetraazatricyclo[7.4.0.0^{26}]trideca-1(13)35911-pentaen-8-yl]acetamide

SMILES

COc1ccc(CNC(CN(c2cccnc2-n(c2c3)nc3-c3cccs3)C2=O)=O)cc1

InChI

InChI=1S/C23H19N5O3S/c1-31-16-8-6-15(7-9-16)13-25-21(29)14-27-18-4-2-10-24-22(18)28-19(23(27)30)12-17(26-28)20-5-3-11-32-20/h2-12H,13-14H2,1H3,(H,25,29)

InChI Key

JUZLQSOZFGGVGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27605835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.091

Distribution Coefficient, logD

3.091

Water Solubility, LogSw

-3.47

Polar Surface Area

70.798

Acid Dissociation Constant (pKa)

14.18

Base Dissociation Constant (pKb)

2.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

P590-0875 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with P590-0875 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P590-0875?
Check Price and Availability of P590-0875, 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 P590-0875 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P590-0875
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P590-0875
  • 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 P590-0875 available by request