K806-0042 Screening compound: 2-methyl-N-{2-[4-(2-methylbenzamido)phenyl]-1H-1,3-benzodiazol-6-yl}benzamide

K806-0042 Screening compound: 2-methyl-N-{2-[4-(2-methylbenzamido)phenyl]-1H-1,3-benzodiazol-6-yl}benzamide
K806-0042 Screening compound: 2-methyl-N-{2-[4-(2-methylbenzamido)phenyl]-1H-1,3-benzodiazol-6-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K806-0042
2-methyl-N-{2-[4-(2-methylbenzamido)phenyl]-1H-1,3-benzodiazol-6-yl}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

K806-0042

Molecular Formula

C29H24N4O2 (C29 H24 N4 O2)

Compound Name

2-methyl-N-{2-[4-(2-methylbenzamido)phenyl]-1H-1,3-benzodiazol-6-yl}benzamide

IUPAC name

n/a

SMILES

Cc(cccc1)c1C(Nc(cc1)ccc1-c1nc(ccc(NC(c2c(C)cccc2)=O)c2)c2[nH]1)=O

InChI

InChI=1S/C29H24N4O2/c1-18-7-3-5-9-23(18)28(34)30-21-13-11-20(12-14-21)27-32-25-16-15-22(17-26(25)33-27)31-29(35)24-10-6-4-8-19(24)2/h3-17H,1-2H3,(H,30,34)(H,31,35)(H,32,33)

InChI Key

LTJWMXXFNBTNPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02938495

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.882

Distribution Coefficient, logD

5.878

Water Solubility, LogSw

-5.47

Polar Surface Area

65.440

Acid Dissociation Constant (pKa)

9.47

Base Dissociation Constant (pKb)

4.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.90

References: we are preparing a list of scientific research reports with K806-0042 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K806-0042?
Check Price and Availability of K806-0042, 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 K806-0042 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K806-0042
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K806-0042
  • 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 K806-0042 available by request