2326-3277 Screening compound: 7-(4-chlorophenyl)-4-(4-ethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile

2326-3277 Screening compound: 7-(4-chlorophenyl)-4-(4-ethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2326-3277 Screening compound: 7-(4-chlorophenyl)-4-(4-ethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 2326-3277
7-(4-chlorophenyl)-4-(4-ethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-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

2326-3277

Molecular Formula

C25H23ClN2O (C25 H23 ClN2 O)

Compound Name

7-(4-chlorophenyl)-4-(4-ethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile

IUPAC name

7-(4-chlorophenyl)-4-(4-ethylphenyl)-2-methyl-5-oxo-145678-hexahydroquinoline-3-carbonitrile

SMILES

CCc1ccc(C2C(C#N)=C(C)NC(CC(C3)c(cc4)ccc4Cl)=C2C3=O)cc1

InChI

InChI=1S/C25H23ClN2O/c1-3-16-4-6-18(7-5-16)24-21(14-27)15(2)28-22-12-19(13-23(29)25(22)24)17-8-10-20(26)11-9-17/h4-11,19,24,28H,3,12-13H2,1-2H3

InChI Key

YVSYNIBPCWPKOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01445580

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.92

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.961

Distribution Coefficient, logD

2.867

Water Solubility, LogSw

-6.50

Polar Surface Area

40.706

Acid Dissociation Constant (pKa)

4.31

Base Dissociation Constant (pKb)

-3.49

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

28.00

2326-3277 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 2326-3277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2326-3277?
Check Price and Availability of 2326-3277, 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 2326-3277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2326-3277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2326-3277
  • 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 2326-3277 available by request