C786-3998 Screening compound: N-CYCLOPROPYL-2-{8-FLUORO-1-OXO-1H,2H-[1,2,4]TRIAZINO[4,5-A]INDOL-2-YL}ACETAMIDE

C786-3998 Screening compound: N-CYCLOPROPYL-2-{8-FLUORO-1-OXO-1H,2H-[1,2,4]TRIAZINO[4,5-A]INDOL-2-YL}ACETAMIDE
C786-3998 Screening compound: N-CYCLOPROPYL-2-{8-FLUORO-1-OXO-1H,2H-[1,2,4]TRIAZINO[4,5-A]INDOL-2-YL}ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C786-3998
N-CYCLOPROPYL-2-{8-FLUORO-1-OXO-1H,2H-[1,2,4]TRIAZINO[4,5-A]INDOL-2-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

C786-3998

Molecular Formula

C15H13FN4O2 (C15 H13 FN4 O2)

Compound Name

N-CYCLOPROPYL-2-{8-FLUORO-1-OXO-1H,2H-[1,2,4]TRIAZINO[4,5-A]INDOL-2-YL}ACETAMIDE

IUPAC name

n/a

SMILES

O=C(CN(C(c1c2)=O)N=Cn1c(cc1)c2cc1F)NC1CC1

InChI

InChI=1S/C15H13FN4O2/c16-10-1-4-12-9(5-10)6-13-15(22)20(17-8-19(12)13)7-14(21)18-11-2-3-11/h1,4-6,8,11H,2-3,7H2,(H,18,21)

InChI Key

HJCQXNOQLXAMCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26966345

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.943

Distribution Coefficient, logD

0.943

Water Solubility, LogSw

-2.33

Polar Surface Area

54.211

Acid Dissociation Constant (pKa)

14.15

Base Dissociation Constant (pKb)

3.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

C786-3998 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

Soluble Diversity Library (15920 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with C786-3998 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C786-3998?
Check Price and Availability of C786-3998, 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 C786-3998 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C786-3998
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C786-3998
  • 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 C786-3998 available by request