E856-3092 Screening compound: 4-{[2-(4-methoxyphenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}-N-(3-methoxypropyl)benzamide

E856-3092 Screening compound: 4-{[2-(4-methoxyphenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}-N-(3-methoxypropyl)benzamide
E856-3092 Screening compound: 4-{[2-(4-methoxyphenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}-N-(3-methoxypropyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E856-3092
4-{[2-(4-methoxyphenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}-N-(3-methoxypropyl)benzamide

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

E856-3092

Molecular Formula

C25H28N4O4 (C25 H28 N4 O4)

Compound Name

4-{[2-(4-methoxyphenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}-N-(3-methoxypropyl)benzamide

IUPAC name

4-{[2-(4-methoxyphenyl)-5-oxo-4H5H6H7H-pyrazolo[15-a]pyrimidin-4-yl]methyl}-N-(3-methoxypropyl)benzamide

SMILES

COCCCNC(c1ccc(CN(c2cc(-c(cc3)ccc3OC)nn2CC2)C2=O)cc1)=O

InChI

InChI=1S/C25H28N4O4/c1-32-15-3-13-26-25(31)20-6-4-18(5-7-20)17-28-23-16-22(27-29(23)14-12-24(28)30)19-8-10-21(33-2)11-9-19/h4-11,16H,3,12-15,17H2,1-2H3,(H,26,31)

InChI Key

DRLXVBDRFXRCGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27602855

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.094

Distribution Coefficient, logD

3.094

Water Solubility, LogSw

-3.38

Polar Surface Area

68.433

Acid Dissociation Constant (pKa)

14.11

Base Dissociation Constant (pKb)

-1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

E856-3092 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with E856-3092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E856-3092?
Check Price and Availability of E856-3092, 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 E856-3092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E856-3092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E856-3092
  • 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 E856-3092 available by request