F779-0876 Screening compound: N-{3-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-5-chloro-1H-indole-2-carboxamide

F779-0876 Screening compound: N-{3-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-5-chloro-1H-indole-2-carboxamide
F779-0876 Screening compound: N-{3-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-5-chloro-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F779-0876
N-{3-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-5-chloro-1H-indole-2-carboxamide

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

F779-0876

Molecular Formula

C24H19ClN4O (C24 H19 ClN4 O)

Compound Name

N-{3-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-5-chloro-1H-indole-2-carboxamide

IUPAC name

N-{3-[2-(1H-13-benzodiazol-2-yl)ethyl]phenyl}-5-chloro-1H-indole-2-carboxamide

SMILES

O=C(c1cc(cc(cc2)Cl)c2[nH]1)Nc1cc(CCc2nc(cccc3)c3[nH]2)ccc1

InChI

InChI=1S/C24H19ClN4O/c25-17-9-10-19-16(13-17)14-22(27-19)24(30)26-18-5-3-4-15(12-18)8-11-23-28-20-6-1-2-7-21(20)29-23/h1-7,9-10,12-14,27H,8,11H2,(H,26,30)(H,28,29)

InChI Key

SBBMTDRSBIWSJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14966194

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.89

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.106

Distribution Coefficient, logD

6.081

Water Solubility, LogSw

-6.33

Polar Surface Area

52.689

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

6.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

F779-0876 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Targeted Diversity Library (40567 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Proteases
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F779-0876 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F779-0876?
Check Price and Availability of F779-0876, 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 F779-0876 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F779-0876
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F779-0876
  • 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 F779-0876 available by request