6049-2622 Screening compound: 4-[2-amino-3-cyano-4-(2-fluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-1-yl]benzene-1-sulfonamide

6049-2622 Screening compound: 4-[2-amino-3-cyano-4-(2-fluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-1-yl]benzene-1-sulfonamide
6049-2622 Screening compound: 4-[2-amino-3-cyano-4-(2-fluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-1-yl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-2622
4-[2-amino-3-cyano-4-(2-fluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-1-yl]benzene-1-sulfonamide

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

6049-2622

Molecular Formula

C24H23FN4O3S (C24 H23 FN4 O3 S)

Compound Name

4-[2-amino-3-cyano-4-(2-fluorophenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-1-yl]benzene-1-sulfonamide

IUPAC name

4-[2-amino-3-cyano-4-(2-fluorophenyl)-77-dimethyl-5-oxo-145678-hexahydroquinolin-1-yl]benzene-1-sulfonamide

SMILES

CC(C)(C1)CC(N(c(cc2)ccc2S(N)(=O)=O)C(N)=C(C2c(cccc3)c3F)C#N)=C2C1=O

InChI

InChI=1S/C24H23FN4O3S/c1-24(2)11-19-22(20(30)12-24)21(16-5-3-4-6-18(16)25)17(13-26)23(27)29(19)14-7-9-15(10-8-14)33(28,31)32/h3-10,21H,11-12,27H2,1-2H3,(H2,28,31,32)/t21-/m0/s1

InChI Key

LUMYGMRQRSFRPZ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD03758627

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.357

Distribution Coefficient, logD

2.356

Water Solubility, LogSw

-2.66

Polar Surface Area

102.980

Acid Dissociation Constant (pKa)

10.01

Base Dissociation Constant (pKb)

-4.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

6049-2622 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 6049-2622 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-2622?
Check Price and Availability of 6049-2622, 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 6049-2622 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-2622
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-2622
  • 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 6049-2622 available by request