D073-0316 Screening compound: N-[2-(5-benzenesulfonamido-1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]cyclohexanecarboxamide

D073-0316 Screening compound: N-[2-(5-benzenesulfonamido-1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]cyclohexanecarboxamide
D073-0316 Screening compound: N-[2-(5-benzenesulfonamido-1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D073-0316
N-[2-(5-benzenesulfonamido-1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]cyclohexanecarboxamide

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

D073-0316

Molecular Formula

C23H28N4O3S (C23 H28 N4 O3 S)

Compound Name

N-[2-(5-benzenesulfonamido-1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]cyclohexanecarboxamide

IUPAC name

N-[2-(5-benzenesulfonamido-1-methyl-1H-13-benzodiazol-2-yl)ethyl]cyclohexanecarboxamide

SMILES

Cn1c(ccc(NS(c2ccccc2)(=O)=O)c2)c2nc1CCNC(C1CCCCC1)=O

InChI

InChI=1S/C23H28N4O3S/c1-27-21-13-12-18(26-31(29,30)19-10-6-3-7-11-19)16-20(21)25-22(27)14-15-24-23(28)17-8-4-2-5-9-17/h3,6-7,10-13,16-17,26H,2,4-5,8-9,14-15H2,1H3,(H,24,28)

InChI Key

KJGKSHDMJZZWGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07392548

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.513

Distribution Coefficient, logD

3.441

Water Solubility, LogSw

-3.87

Polar Surface Area

77.321

Acid Dissociation Constant (pKa)

8.58

Base Dissociation Constant (pKb)

6.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

D073-0316 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with D073-0316 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D073-0316?
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What is the minimum amount of D073-0316 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D073-0316
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D073-0316
  • 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 D073-0316 available by request