C153-0519 Screening compound: 5-(diethylsulfamoyl)-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-benzofuran-2-carboxamide

C153-0519 Screening compound: 5-(diethylsulfamoyl)-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-benzofuran-2-carboxamide
C153-0519 Screening compound: 5-(diethylsulfamoyl)-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C153-0519
5-(diethylsulfamoyl)-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-benzofuran-2-carboxamide

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

C153-0519

Molecular Formula

C24H28N2O4S (C24 H28 N2 O4 S)

Compound Name

5-(diethylsulfamoyl)-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-benzofuran-2-carboxamide

IUPAC name

5-(diethylsulfamoyl)-3-methyl-N-(1234-tetrahydronaphthalen-1-yl)-1-benzofuran-2-carboxamide

SMILES

CCN(CC)S(c(cc1)cc2c1oc(C(NC(CCC1)c3c1cccc3)=O)c2C)(=O)=O

InChI

InChI=1S/C24H28N2O4S/c1-4-26(5-2)31(28,29)18-13-14-22-20(15-18)16(3)23(30-22)24(27)25-21-12-8-10-17-9-6-7-11-19(17)21/h6-7,9,11,13-15,21H,4-5,8,10,12H2,1-3H3,(H,25,27)/t21-/m0/s1

InChI Key

NXDIEEQCFQCJGG-NRFANRHFSA-N

MDL Number (MFCD)

MFCD05031641

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.867

Distribution Coefficient, logD

4.866

Water Solubility, LogSw

-4.62

Polar Surface Area

64.118

Acid Dissociation Constant (pKa)

10.43

Base Dissociation Constant (pKb)

-0.82

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

C153-0519 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C153-0519 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C153-0519?
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What is the minimum amount of C153-0519 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C153-0519
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C153-0519
  • 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 C153-0519 available by request