4135-0020 Screening compound: 1,2-dimethyl-1H-naphtho[2,3-d]imidazole

4135-0020 Screening compound: 1,2-dimethyl-1H-naphtho[2,3-d]imidazole
4135-0020 Screening compound: 1,2-dimethyl-1H-naphtho[2,3-d]imidazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4135-0020
1,2-dimethyl-1H-naphtho[2,3-d]imidazole

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

4135-0020

Molecular Formula

C13H12N2 (C13 H12 N2)

Compound Name

1,2-dimethyl-1H-naphtho[2,3-d]imidazole

IUPAC name

12-dimethyl-1H-naphtho[23-d]imidazole

SMILES

Cc1nc2cc3ccccc3cc2n1C

InChI

InChI=1S/C13H12N2/c1-9-14-12-7-10-5-3-4-6-11(10)8-13(12)15(9)2/h3-8H,1-2H3

InChI Key

YOOTWGQEOZEBEG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00839261

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

196.25

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.871

Distribution Coefficient, logD

2.308

Water Solubility, LogSw

-3.14

Polar Surface Area

11.754

Acid Dissociation Constant (pKa)

26.55

Base Dissociation Constant (pKb)

7.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

4135-0020 in Drug Discovery

Included in Screening Libraries

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

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 4135-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4135-0020?
Check Price and Availability of 4135-0020, 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 4135-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4135-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4135-0020
  • 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 4135-0020 available by request