G514-0342 Screening compound: 2-methoxy-4,5-dimethyl-N-[1-(propane-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl]benzene-1-sulfonamide

G514-0342 Screening compound: 2-methoxy-4,5-dimethyl-N-[1-(propane-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl]benzene-1-sulfonamide
G514-0342 Screening compound: 2-methoxy-4,5-dimethyl-N-[1-(propane-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G514-0342
2-methoxy-4,5-dimethyl-N-[1-(propane-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-7-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

G514-0342

Molecular Formula

C21H28N2O5S2 (C21 H28 N2 O5 S2)

Compound Name

2-methoxy-4,5-dimethyl-N-[1-(propane-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-7-yl]benzene-1-sulfonamide

IUPAC name

2-methoxy-45-dimethyl-N-[1-(propane-1-sulfonyl)-1234-tetrahydroquinolin-7-yl]benzene-1-sulfonamide

SMILES

CCCS(N(CCC1)c2c1ccc(NS(c(cc(C)c(C)c1)c1OC)(=O)=O)c2)(=O)=O

InChI

InChI=1S/C21H28N2O5S2/c1-5-11-29(24,25)23-10-6-7-17-8-9-18(14-19(17)23)22-30(26,27)21-13-16(3)15(2)12-20(21)28-4/h8-9,12-14,22H,5-7,10-11H2,1-4H3

InChI Key

VCWZBAZWSPLPIP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09236776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.6

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.834

Distribution Coefficient, logD

3.774

Water Solubility, LogSw

-3.91

Polar Surface Area

79.837

Acid Dissociation Constant (pKa)

8.23

Base Dissociation Constant (pKb)

-7.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

G514-0342 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system

References: we are preparing a list of scientific research reports with G514-0342 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G514-0342?
Check Price and Availability of G514-0342, 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 G514-0342 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G514-0342
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G514-0342
  • 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 G514-0342 available by request