D125-0984 Screening compound: N-{[1-(2-cyclohexylethyl)-1H-1,3-benzodiazol-2-yl]methyl}benzamide

D125-0984 Screening compound: N-{[1-(2-cyclohexylethyl)-1H-1,3-benzodiazol-2-yl]methyl}benzamide
D125-0984 Screening compound: N-{[1-(2-cyclohexylethyl)-1H-1,3-benzodiazol-2-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D125-0984
N-{[1-(2-cyclohexylethyl)-1H-1,3-benzodiazol-2-yl]methyl}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

D125-0984

Molecular Formula

C23H27N3O (C23 H27 N3 O)

Compound Name

N-{[1-(2-cyclohexylethyl)-1H-1,3-benzodiazol-2-yl]methyl}benzamide

IUPAC name

N-{[1-(2-cyclohexylethyl)-1H-13-benzodiazol-2-yl]methyl}benzamide

SMILES

O=C(c1ccccc1)NCc1nc(cccc2)c2n1CCC1CCCCC1

InChI

InChI=1S/C23H27N3O/c27-23(19-11-5-2-6-12-19)24-17-22-25-20-13-7-8-14-21(20)26(22)16-15-18-9-3-1-4-10-18/h2,5-8,11-14,18H,1,3-4,9-10,15-17H2,(H,24,27)

InChI Key

SZNQHYRINBFUSL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08163312

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.399

Distribution Coefficient, logD

5.399

Water Solubility, LogSw

-5.77

Polar Surface Area

35.727

Acid Dissociation Constant (pKa)

10.47

Base Dissociation Constant (pKb)

3.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

D125-0984 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CORONAVIRUS Library (20774 compounds)

Immunological Library (6760 compounds)

Nucleic Acid Ligands (8311 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with D125-0984 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D125-0984?
Check Price and Availability of D125-0984, 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 D125-0984 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D125-0984
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D125-0984
  • 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 D125-0984 available by request