C784-3320 Screening compound: 4-[5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl]-N~1~-(1-methyl-3-phenylpropyl)butanamide

C784-3320 Screening compound: 4-[5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl]-N~1~-(1-methyl-3-phenylpropyl)butanamide
C784-3320 Screening compound: 4-[5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl]-N~1~-(1-methyl-3-phenylpropyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C784-3320
4-[5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl]-N~1~-(1-methyl-3-phenylpropyl)butanamide

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

C784-3320

Molecular Formula

C25H30N4O3 (C25 H30 N4 O3)

Compound Name

4-[5-ethyl-2-methyl-8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl]-N~1~-(1-methyl-3-phenylpropyl)butanamide

IUPAC name

4-{12-ethyl-4-methyl-9-oxo-5-oxa-11011-triazatricyclo[6.4.0.0^{26}]dodeca-2(6)3711-tetraen-10-yl}-N-(4-phenylbutan-2-yl)butanamide

SMILES

CCC(n1c2cc3c1cc(C)o3)=NN(CCCC(NC(C)CCc1ccccc1)=O)C2=O

InChI

InChI=1S/C25H30N4O3/c1-4-23-27-28(25(31)21-16-22-20(29(21)23)15-18(3)32-22)14-8-11-24(30)26-17(2)12-13-19-9-6-5-7-10-19/h5-7,9-10,15-17H,4,8,11-14H2,1-3H3,(H,26,30)/t17-/m0/s1

InChI Key

SHOVPKJSLOFNKP-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD14794342

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.502

Distribution Coefficient, logD

3.487

Water Solubility, LogSw

-3.72

Polar Surface Area

62.345

Acid Dissociation Constant (pKa)

14.96

Base Dissociation Constant (pKb)

5.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

C784-3320 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C784-3320 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C784-3320?
Check Price and Availability of C784-3320, 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 C784-3320 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C784-3320
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C784-3320
  • 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 C784-3320 available by request