8012-7387 Screening compound: N-{1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl}-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide

8012-7387 Screening compound: N-{1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl}-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide
8012-7387 Screening compound: N-{1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl}-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-7387
N-{1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl}-N-[2-(2-methyl-1H-indol-3-yl)ethyl]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

8012-7387

Molecular Formula

C33H37N3O2 (C33 H37 N3 O2)

Compound Name

N-{1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl}-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide

IUPAC name

N-{1-[(26-dimethylphenyl)carbamoyl]cyclohexyl}-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide

SMILES

Cc1c(CCN(C2(CCCCC2)C(Nc2c(C)cccc2C)=O)C(c2ccccc2)=O)c(cccc2)c2[nH]1

InChI

InChI=1S/C33H37N3O2/c1-23-13-12-14-24(2)30(23)35-32(38)33(20-10-5-11-21-33)36(31(37)26-15-6-4-7-16-26)22-19-27-25(3)34-29-18-9-8-17-28(27)29/h4,6-9,12-18,34H,5,10-11,19-22H2,1-3H3,(H,35,38)

InChI Key

DGCLUSFTGZSRRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03133640

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.68

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.531

Distribution Coefficient, logD

6.531

Water Solubility, LogSw

-5.86

Polar Surface Area

47.006

Acid Dissociation Constant (pKa)

11.41

Base Dissociation Constant (pKb)

-2.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8012-7387 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8012-7387 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-7387?
Check Price and Availability of 8012-7387, 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 8012-7387 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-7387
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-7387
  • 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 8012-7387 available by request