G416-4194 Screening compound: N-(4-METHOXYBENZYL)-5-[METHYL(PHENYLSULFONYL)AMINO]NICOTINAMIDE

G416-4194 Screening compound: N-(4-METHOXYBENZYL)-5-[METHYL(PHENYLSULFONYL)AMINO]NICOTINAMIDE
G416-4194 Screening compound: N-(4-METHOXYBENZYL)-5-[METHYL(PHENYLSULFONYL)AMINO]NICOTINAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound G416-4194
N-(4-METHOXYBENZYL)-5-[METHYL(PHENYLSULFONYL)AMINO]NICOTINAMIDE

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

G416-4194

Molecular Formula

C21H21N3O4S (C21 H21 N3 O4 S)

Compound Name

N-(4-METHOXYBENZYL)-5-[METHYL(PHENYLSULFONYL)AMINO]NICOTINAMIDE

IUPAC name

n/a

SMILES

CN(c1cncc(C(NCc(cc2)ccc2OC)=O)c1)S(c1ccccc1)(=O)=O

InChI

InChI=1S/C21H21N3O4S/c1-24(29(26,27)20-6-4-3-5-7-20)18-12-17(14-22-15-18)21(25)23-13-16-8-10-19(28-2)11-9-16/h3-12,14-15H,13H2,1-2H3,(H,23,25)

InChI Key

FYIFPBRRPQKWDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27140233

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.837

Distribution Coefficient, logD

2.836

Water Solubility, LogSw

-3.48

Polar Surface Area

74.624

Acid Dissociation Constant (pKa)

12.66

Base Dissociation Constant (pKb)

4.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

G416-4194 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with G416-4194 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G416-4194?
Check Price and Availability of G416-4194, 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 G416-4194 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G416-4194
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G416-4194
  • 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 G416-4194 available by request