2211-0118 Screening compound: 2-benzyl-1-propyl-1H-1,3-benzodiazole

2211-0118 Screening compound: 2-benzyl-1-propyl-1H-1,3-benzodiazole
2211-0118 Screening compound: 2-benzyl-1-propyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 2211-0118
2-benzyl-1-propyl-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

2211-0118

Molecular Formula

C17H18N2 (C17 H18 N2)

Compound Name

2-benzyl-1-propyl-1H-1,3-benzodiazole

IUPAC name

2-benzyl-1-propyl-1H-13-benzodiazole

SMILES

CCCn1c(cccc2)c2nc1Cc1ccccc1

InChI

InChI=1S/C17H18N2/c1-2-12-19-16-11-7-6-10-15(16)18-17(19)13-14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3

InChI Key

GVVCOEAQRZLIDI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01815856

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

250.34

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.470

Distribution Coefficient, logD

4.469

Water Solubility, LogSw

-4.35

Polar Surface Area

11.122

Acid Dissociation Constant (pKa)

24.48

Base Dissociation Constant (pKb)

4.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

2211-0118 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 2211-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2211-0118?
Check Price and Availability of 2211-0118, 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 2211-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2211-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2211-0118
  • 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 2211-0118 available by request