3282-0451 Screening compound: 1-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1H-1,3-benzodiazol-5-amine

3282-0451 Screening compound: 1-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1H-1,3-benzodiazol-5-amine
3282-0451 Screening compound: 1-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1H-1,3-benzodiazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3282-0451
1-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1H-1,3-benzodiazol-5-amine

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

3282-0451

Molecular Formula

C22H21N3O2 (C22 H21 N3 O2)

Compound Name

1-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1H-1,3-benzodiazol-5-amine

IUPAC name

1-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1H-13-benzodiazol-5-amine

SMILES

COc(cc1)ccc1-n1c(ccc(NCc(cccc2)c2OC)c2)c2nc1

InChI

InChI=1S/C22H21N3O2/c1-26-19-10-8-18(9-11-19)25-15-24-20-13-17(7-12-21(20)25)23-14-16-5-3-4-6-22(16)27-2/h3-13,15,23H,14H2,1-2H3

InChI Key

CWVNGHGRVCDVIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02223878

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.439

Distribution Coefficient, logD

4.182

Water Solubility, LogSw

-4.41

Polar Surface Area

36.291

Acid Dissociation Constant (pKa)

18.85

Base Dissociation Constant (pKb)

7.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

3282-0451 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Anti-Inflammatory Library (24602 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Immune system

References: we are preparing a list of scientific research reports with 3282-0451 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3282-0451?
Check Price and Availability of 3282-0451, 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 3282-0451 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3282-0451
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3282-0451
  • 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 3282-0451 available by request