E524-1195 Screening compound: N~1~-(3-bromobenzyl)-3-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]propanamide

E524-1195 Screening compound: N~1~-(3-bromobenzyl)-3-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]propanamide
E524-1195 Screening compound: N~1~-(3-bromobenzyl)-3-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E524-1195
N~1~-(3-bromobenzyl)-3-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-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

E524-1195

Molecular Formula

C20H17BrN4O2 (C20 H17 BrN4 O2)

Compound Name

N~1~-(3-bromobenzyl)-3-[6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl]propanamide

IUPAC name

N-[(3-bromophenyl)methyl]-3-{7-oxo-2810-triazatricyclo[7.4.0.0^{26}]trideca-1(13)35911-pentaen-8-yl}propanamide

SMILES

O=C(CCN(C1=O)c2ncccc2-n2c1ccc2)NCc1cccc(Br)c1

InChI

InChI=1S/C20H17BrN4O2/c21-15-5-1-4-14(12-15)13-23-18(26)8-11-25-19-16(6-2-9-22-19)24-10-3-7-17(24)20(25)27/h1-7,9-10,12H,8,11,13H2,(H,23,26)

InChI Key

AOYYRJQBWGQYPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14894957

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.217

Distribution Coefficient, logD

3.217

Water Solubility, LogSw

-3.38

Polar Surface Area

51.746

Acid Dissociation Constant (pKa)

12.54

Base Dissociation Constant (pKb)

2.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with E524-1195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E524-1195?
Check Price and Availability of E524-1195, 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 E524-1195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E524-1195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E524-1195
  • 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 E524-1195 available by request