8019-3275 Screening compound: 2-benzyl-1-(2-cyclohexylethyl)-1H-1,3-benzodiazole

8019-3275 Screening compound: 2-benzyl-1-(2-cyclohexylethyl)-1H-1,3-benzodiazole
8019-3275 Screening compound: 2-benzyl-1-(2-cyclohexylethyl)-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-3275
2-benzyl-1-(2-cyclohexylethyl)-1H-1,3-benzodiazole

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

8019-3275

Molecular Formula

C22H26N2 (C22 H26 N2)

Compound Name

2-benzyl-1-(2-cyclohexylethyl)-1H-1,3-benzodiazole

IUPAC name

2-benzyl-1-(2-cyclohexylethyl)-1H-13-benzodiazole

SMILES

C(Cn1c(cccc2)c2nc1Cc1ccccc1)C1CCCCC1

InChI

InChI=1S/C22H26N2/c1-3-9-18(10-4-1)15-16-24-21-14-8-7-13-20(21)23-22(24)17-19-11-5-2-6-12-19/h2,5-8,11-14,18H,1,3-4,9-10,15-17H2

InChI Key

TXRXXLBWYHLZCC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03669424

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.46

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

6.331

Distribution Coefficient, logD

6.330

Water Solubility, LogSw

-6.17

Polar Surface Area

11.042

Acid Dissociation Constant (pKa)

24.51

Base Dissociation Constant (pKb)

4.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

8019-3275 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8019-3275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-3275?
Check Price and Availability of 8019-3275, 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 8019-3275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-3275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-3275
  • 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 8019-3275 available by request