G504-0138 Screening compound: 4-butoxy-N-[1-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzamide

G504-0138 Screening compound: 4-butoxy-N-[1-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzamide
G504-0138 Screening compound: 4-butoxy-N-[1-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G504-0138
4-butoxy-N-[1-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzamide

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

G504-0138

Molecular Formula

C27H30N2O4S (C27 H30 N2 O4 S)

Compound Name

4-butoxy-N-[1-(4-methylbenzenesulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzamide

IUPAC name

4-butoxy-N-[1-(4-methylbenzenesulfonyl)-1234-tetrahydroquinolin-6-yl]benzamide

SMILES

CCCCOc(cc1)ccc1C(Nc(cc1)cc(CCC2)c1N2S(c1ccc(C)cc1)(=O)=O)=O

InChI

InChI=1S/C27H30N2O4S/c1-3-4-18-33-24-12-9-21(10-13-24)27(30)28-23-11-16-26-22(19-23)6-5-17-29(26)34(31,32)25-14-7-20(2)8-15-25/h7-16,19H,3-6,17-18H2,1-2H3,(H,28,30)

InChI Key

KGQQNQUFIJUUSN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09235883

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.621

Distribution Coefficient, logD

5.621

Water Solubility, LogSw

-5.27

Polar Surface Area

61.900

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

-0.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

G504-0138 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G504-0138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G504-0138?
Check Price and Availability of G504-0138, 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 G504-0138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G504-0138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G504-0138
  • 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 G504-0138 available by request