2326-3249 Screening compound: 4-(2-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile

2326-3249 Screening compound: 4-(2-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2326-3249 Screening compound: 4-(2-bromophenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 2326-3249
4-(2-bromophenyl)-7-(4-chlorophenyl)-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

2326-3249

Molecular Formula

C23H18BrClN2O (C23 H18 BrClN2 O)

Compound Name

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

IUPAC name

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

SMILES

CC(NC(CC(C1)c(cc2)ccc2Cl)=C(C2c(cccc3)c3Br)C1=O)=C2C#N

InChI

InChI=1S/C23H18BrClN2O/c1-13-18(12-26)22(17-4-2-3-5-19(17)24)23-20(27-13)10-15(11-21(23)28)14-6-8-16(25)9-7-14/h2-9,15,22,27H,10-11H2,1H3

InChI Key

XULQZEZCUXXSPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01445570

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.77

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.794

Distribution Coefficient, logD

2.863

Water Solubility, LogSw

-6.24

Polar Surface Area

40.706

Acid Dissociation Constant (pKa)

4.47

Base Dissociation Constant (pKb)

-3.95

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

21.70

2326-3249 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 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 2326-3249 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2326-3249?
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What is the minimum amount of 2326-3249 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2326-3249
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2326-3249
  • 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 2326-3249 available by request