3856-0266 Screening compound: 2-amino-4-(4-chlorophenyl)-5H,6H,7H,8H,9H-cyclohepta[b]pyridine-3-carbonitrile

3856-0266 Screening compound: 2-amino-4-(4-chlorophenyl)-5H,6H,7H,8H,9H-cyclohepta[b]pyridine-3-carbonitrile
3856-0266 Screening compound: 2-amino-4-(4-chlorophenyl)-5H,6H,7H,8H,9H-cyclohepta[b]pyridine-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 3856-0266
2-amino-4-(4-chlorophenyl)-5H,6H,7H,8H,9H-cyclohepta[b]pyridine-3-carbonitrile

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

3856-0266

Molecular Formula

C17H16ClN3 (C17 H16 ClN3)

Compound Name

2-amino-4-(4-chlorophenyl)-5H,6H,7H,8H,9H-cyclohepta[b]pyridine-3-carbonitrile

IUPAC name

2-amino-4-(4-chlorophenyl)-5H6H7H8H9H-cyclohepta[b]pyridine-3-carbonitrile

SMILES

Nc1nc(CCCCC2)c2c(-c(cc2)ccc2Cl)c1C#N

InChI

InChI=1S/C17H16ClN3/c18-12-8-6-11(7-9-12)16-13-4-2-1-3-5-15(13)21-17(20)14(16)10-19/h6-9H,1-5H2,(H2,20,21)

InChI Key

UWJJUVDTKOUNNX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00981466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.79

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.581

Distribution Coefficient, logD

4.581

Water Solubility, LogSw

-5.15

Polar Surface Area

48.088

Acid Dissociation Constant (pKa)

18.94

Base Dissociation Constant (pKb)

4.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

3856-0266 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3856-0266 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3856-0266?
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What is the minimum amount of 3856-0266 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3856-0266
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3856-0266
  • 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 3856-0266 available by request