F796-0226 Screening compound: 2-{8-fluoro-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-3-yl}-N-phenylacetamide

F796-0226 Screening compound: 2-{8-fluoro-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-3-yl}-N-phenylacetamide
F796-0226 Screening compound: 2-{8-fluoro-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-3-yl}-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F796-0226
2-{8-fluoro-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-3-yl}-N-phenylacetamide

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

F796-0226

Molecular Formula

C18H13FN4O2 (C18 H13 FN4 O2)

Compound Name

2-{8-fluoro-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-3-yl}-N-phenylacetamide

IUPAC name

2-{8-fluoro-4-oxo-3H4H5H-pyrimido[54-b]indol-3-yl}-N-phenylacetamide

SMILES

O=C(CN(C=Nc1c2[nH]c(cc3)c1cc3F)C2=O)Nc1ccccc1

InChI

InChI=1S/C18H13FN4O2/c19-11-6-7-14-13(8-11)16-17(22-14)18(25)23(10-20-16)9-15(24)21-12-4-2-1-3-5-12/h1-8,10,22H,9H2,(H,21,24)

InChI Key

HKGRORJWTNQLRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27191023

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.006

Distribution Coefficient, logD

2.006

Water Solubility, LogSw

-2.81

Polar Surface Area

57.446

Acid Dissociation Constant (pKa)

12.91

Base Dissociation Constant (pKb)

0.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

References: we are preparing a list of scientific research reports with F796-0226 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F796-0226?
Check Price and Availability of F796-0226, 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 F796-0226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F796-0226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F796-0226
  • 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 F796-0226 available by request